Evaluation of Chemistry Research in Finland Evaluation Form The Form consists of two parts: Part I. Resources and research output of the Unit Part II. The Unit’s self-assessment Part I: Selected parts of the information provided by the Unit will be published in the evaluation report. Part II: The information provided by the Unit will be used for evaluation purposes only and will not be published. No data concerning individual researchers will be published; the evaluation will not assess persons but the unit as a whole. PART I. RESOURCES AND RESEARCH OUTPUT 1. GENERAL INFORMATION A. Contact information University The Evaluated Unit Address Phone Internet home page The head of the Unit Phone Email Faculty or equivalent higher level of organisation Head of the faculty or equivalent Phone Email University of Jyväskylä Laboratory of Organic Chemistry Survontie 9 +358-14-2602672 https://www.jyu.fi/kemia/tutkimus/orgaaninen/en Academy Professor Kari Rissanen +358-14-2602672 kari.t.rissanen@jyu.fi Chemistry Prof. Jan Lundell +358 14 260 2650 jan.c.lundell@jyu.fi 1 B. The unit’s research profile within the field of evaluation Estimate the percentage that chemistry research represents from all research done in your unit. 100 % Give the information requested in the following Tables of Part I (personnel, funding etc.) only concerning the chemistry part of your research if not explicitly indicated otherwise. Estimate the following chemistry subfield percentages respective to your all chemistry research (sum=100%). Table 1.1 Research % Analytical chemistry Inorganic chemistry Industrial chemistry Materials chemistry Organic chemistry 50 Physical chemistry Polymer chemistry Theoretical chemistry Supramolecular Chemistry 50 2 2. RESOURCES A1. Personnel Include personnel funded through the university to which the unit belongs, or through some other funding source. Include only those graduate students that have carried out their work in the unit. Visiting research staff is not included here but in section A2 below (Tables 2.4. and 2.5.). Calculate Full Time Equivalent (FTE) for the evaluation period: (Total person months for the category) /12/(5 years). Table 2.1 Person months 2005 2006 2007 2008 2009 Total Professors 24 Other senior researchers 48 Postdoctoral researchers 59 Total senior and postdoctoral 131 Postgraduate students 168 Other graduated academic staff 10 Total postgraduate and other 178 Total active research staff 309 Research assistants and graduate students 31 Administrative personnel 0 Technical personnel 36 Total assisting, admin. and technical 67 All staff 507 36 48 61 145 178 11 189 334 29 0 36 65 544 36 53 53 142 176 8 184 326 12 0 36 48 516 45 48 72 165 188 0 188 353 10 0 36 46 564 48 36 107 191 198 0 198 389 27 0 36 63 643 189 233 352 774 908 29 937 1711 109 0 180 289 2774 FTE for the period 3.15 3.88 5.87 12.9 15.1 0.5 15.6 28.5 1.8 0 3 4.8 46.2 List the professors, other senior researchers and postdoctoral researchers for the evaluation period Table 2.2 Name Gender Kari Rissanen M Year of birth 1959 Kari Rissanen Erkki Kolehmainen Maija Nissinen Petri Pihko Jaakko Paasivirta M M F M M 1959 1947 1974 1971 1931 Title Degree Year of awarding Ph.D. Degree awarded by JYU Academy Professor Professor Professor Professor Professor Professor, emeritus Ph.D. Ph.D. Ph.D. Ph.D. P.D. JYU KYU JYU OY OY 1990 1990 2001 1999 1962 1990 Period of employment in the unit 2008-2012 1995-> 2001-> 2006 -> 2008-> 1970 – 1994, works as emeritus 3 Petri Pihko M 1971 Ph.D. OY 1999 2005-2008 Ph.D. Ph.D. JYU JYU 1979 2001 1975-2008 2003 - 2005 Ph.D. JYU 2003 2007-> Ph.D. JYU 1995 2005-2009 Ph.D. JYU 2003 2008-> Ph.D. JYU 1993 1998-2007 Ph.D. JYU 1989 2000 - 2008 1977 1974 1974 1970 1975 1978 Senior Lecturer (TKK) Lecturer Academy Research Fellow Academy Research Fellow Senior Teaching Assistant Senior Teaching Assistant Senior Teaching Assistant Senior Researcher Post doc. Post doc. Post doc. Post doc. Post doc. Post doc. Katri Laihia Maija Nissinen F F 1940 1974 Elina Sievänen F 1977 Juhani Huuskonen M 1963 Tanja Lahtinen F 1970 Erkki Mannila M 1956 Seija Sinkkonen F 1950 Elina Sievänen Jurgen Stahl Luca Russo Tanja Lahtinen Andreina Moreno Shreedhar Bhat F M M F F M Ph.D. Ph.D. Ph.D. Ph.D. Ph.D. Ph.D. 2003 2002 2005 2003 2005 2006 2005-> 2006 2005 2005 - 2006 2005 - 2007 2006 2006 M 1977 Post doc. Ph.D. 2005 2008-2009 Zoran Dzolic M 1974 Post doc. Ph.D. 2007 2007-2009 Arto Valkonen Marta Pontini M F 1978 1980 Post doc. Post doc. Ph.D. Ph.D. 2008 2009 2008-> 2009-> Jens Bunzen M 1979 Post doc. Ph.D. 2009 2009-> Ngong Kodiah Beyeh Prus Piotr M 1977 Post doc. Ph.D. JYU GER UK JYU JoY IIS, Bangalore , India La Sapienza, Rome, Italy RBI, Zagreb, Croatia JYU Univ. Padova, Italy Univ. Bonn, Germany JYU Massimo Cametti 2008 2009-> M 1969 Post doc. Ph.D. 2003 2007-2008 Babita Behera F 1978 Post doc. Ph.D. 2006 2007-2008 Nonappa M 1980 Post doc. Ph.D. Polish Academy of Science H.N.B. Garhwal Univ.,UA, India IIS, Bangl, India 2008 2009-> 4 Meryem Benohoud F 1981 Post doc. Ph.D. Irene Breuer F 1975 Post doc. (TKK) Dr. rer. nat. Daniele Castagnolo M 1978 Post doc. (TKK) Ph.D. Melanie Clarke F 1979 Post doc. (TKK) Ph.D. Laurent Evanno M 1981 Post doc. (TKK) Ph.D. Hannes Helmboldt M 1977 Post doc. (TKK) Dr. rer. nat. Syam Krishnan M 1980 Post doc. Ph.D. Jun Liu M 1979 Post doc. Ph.D. Hasibur Rahaman M 1978 Post doc. Ph.D. University Paris-Sud XI (Orsay), France RWTH Aachen, Germany University of Siena, Italy University of Nottingha m, UK 2008 2009-> 2005 2005-2006 2006 2006-2007 2004 2004-2006 Pierre and Marie Curie University , Paris, France Technisch e Universitä t Dresden, Germany NIISTCSIR/ University of Kerala, India Northwes tern National University , China University of Pune, India 2007 2007-2008 2006 2007-2008 2007 2008-2009 2007 2009-> 2008 2009-> Indicate which percentage of the research is carried out by postgraduates and which by PhDs. Estimate also the percentage of the research funding used to basic and applied research. 5 Table 2.3 Type of Research % Research Funding % Research done by postgraduates % Research done by PhDs Basic 85 50 Applied 15 80 50 20 Total 100 A2. Visiting researchers Include visiting researchers when the funding for the visit has been arranged through the activity of your unit (e.g. Academy of Finland, Tekes, EU funding). Table 2.4 Person months 2005 2006 2007 2008 2009 Total Visiting Professors Visiting senior researchers Visiting Postdoctoral researchers Visiting Postgraduate students 1 0 0 1 6 0 0 4 0 0 0 9 0 0 0 6 0 0 0 4 7 0 0 24 FTE for the period 0.12 0 0 0.40 All visiting researchers 2 10 9 6 4 31 0.52 List the visiting professors, visiting senior researchers and visiting postdoctoral researchers here. The postgraduate students will be listed in section 4E, Visits to the Unit, Table 4.7. Table 2.5 Name Gend er M Title Degree Prof. Ph.D. Pierangelo Metrangolo M Prof. Ph.D. Christoph Schalley M Priv. Doz. Ph.D. Christoph Schalley M Priv. Doz. Ph.D. Joao Rodrigues Period of visit 20.9 – 20.12. 2006 1. – 31.11. 2006 15.915.10. 2005 20.820.9. 2006 Home organisation and the subunit Univ. Madeira, Dept. Chem. Country Portugal Source of Funding PFC Tech. Univ. Milan, Dept. Chem. Italy JYU Univ. Bonn, Dept. Chem. Germany DAAD Univ. Bonn, Dept. Chem. Germany DAAD 6 B. Funding Table 2.6 Core funding External funding Total 2005 2006 2007 2008 2009 616500 653781 706273 728435 616500 437020 653781 389900 706273 452560 728435 653802 775088 150000 925088 778142 Total 3 480 077 150 000 3 630 077 2 711 424 48000 86000 137000 174000 130000 575 000 168000 198000 68000 50000 100000 584 000 Other public sources Industry - - - - - 33000 25000 16000 144286 154717 373003 Private foundations EU - 15000 16000 17300 1300 49600 - - - - - - Other foreign organisations - 36325 36325 36325 - 108975 1 302 520 1 404 006 1 432 158 1 804 148 2 089 247 Budget funding Other Academy of Finland Graduate schools (Min.Edu.) Tekes - 8 032 079 7 3. RESEARCH OUTPUT A. Numbers of scientific publications and other outputs Table 3.1 1. Articles in refereed scientific journals 2. Articles in refereed scientific edited volumes and conference proceedings 3. Scientific Monographs (excluding theses) 4. Text books and other research volumes (e.g. edited proceedings) 5. Research reports (e.g. laboratory reports) 6. Other scientific publications (e.g. nonrefereed articles) 7. National patents, granted 8. National patents, applied 9. International patents, granted 10. International patents, applied 11. Other, specify, chapter in science philosophy book, ISBN: 978-951-884-448-1 2005 2006 2007 2008 2009 35 51 48 38 38 1 2 1 4 4 1 1 1 1 2 2 2 2 1 1 1 2008 18 19 17 4 2009 4 19 17 4 B. Degrees Table 3.2 Master’s degree Number of postgraduate students Number of full time postgraduate students Completed doctoral degree 2005 15 15 14 0 2006 9 17 16 2 2007 10 18 16 1 8 List of doctoral dissertations in 2005-2009. Table 3.3 Name (family name, given name) Year of birth G e n d e r Title of dissertation Mansikkamäki Heidi Busi Sara 1977 F Self-Assembly of Resorcinarenes 1978 F Mäntykoski Keijo 1956 M Erkkilä Anniina 1980 F Sami Nummelin 1968 M Arto Valkonen 1978 M Ngong Kodian Beyeh 1977 M Anna Lähde 1974 F Juha Koivukorpi 1970 M Tero Tuuttila 1973 M Kirsi Salorinne 1978 F Aho Jatta 1979 F Synthesis, Characterization and Thermal Properties of New Quaternary Ammonium Compounds: New Materials for Electrolytes, Ionic Liquids and Complexation Studies PCBs in Process, Products and Environment of Paper Mills Using Wastepaper as Their Raw Material Advances in Amine Catalysis. Bronsted Acids in Iminium and Enamine Activation Synthesis, Characterization, Structural and Retrostructural Analysis of Selfassembling Pore Forming Dendrimers Structural Characteristics and Properties of Substituted Cholanoates and N-Substituted Cholanamides Resorcinarenes and Their Derivatives: Synthesis, Characterization and Complexation in Gas Phase and in Solution Production and Surface Modification of Pharmaceutical Nano- and Microparticles with the Aerosol Flow Reactor Bile acid-arene conjugates: From photoswitchhability to cancer cell detection Functional Dendritic Polyester Compounds: Synthesis and Characterization of Small Bifunctional Dendrimers and Dyes Tetramethoxy Resorcinarene Based cation and Anion receptors. Synthesis, Characterization and Binding Properties Synthesis of the C10-epi-ABCDE Fragment of the Pectenotoxins Year of starti ng postg radua te studie s 2002 Year of compl eting degre e Years worked in the unit during postgra duate studies Present employment (job description, organisation) 2006 5 2003 2006 worked outside unit Researcher, BASF, Ludwigshaven Maternity leave 1990 2007 Reseacher, JYU 2003 2007 worked outside unit 4 1997 2008 6 Post doctoral researcher, AU 2002 2008 6 Post doctoral researcher, JYU 2005 2008 4 Post doctoral researcher, JYU 2000 2008 worked outside unit Project manager, KuU 2002 2009 7 Teaching assistant, JYU 2004 2009 6 not known 2005 2009 5 Teaching assistant, JYU 2004 2009 5 Gaia Consulting Maternity leave 9 4. NATIONAL AND INTERNATIONAL COLLABORATION Throughout this section, do not use abbreviations for institutes and universities but spell them out. Target the collaboration and visits to the period of evaluation (2005-2009). More detailed content of the collaboration and important project consortia can be described in Part II: Collaboration. A. Extent of collaboration For your yearly production of refereed journal publications, give the percentages for co-authoring partners outside your unit. Table 4.1 Percentage from refereed journal publications 2005 2006 2007 2008 2009 No co-author outside the unit Domestic co-author Foreign co-author Both domestic and foreign co-authors 17.1 42.9 34.3 5.7 13.8 49.0 33.3 3.9 22.9 54.2 14.6 8.3 36.8 42.1 15.8 5.3 43.6 35.9 12.8 7.7 B. National collaboration List your most important national collaborations. The collaborating organisation may also be from the same university or research institute, or industrial. The type of collaboration may be e.g. joint projects, personal collaboration, research mobility, networking. The results may be e.g.: Refereed scientific publications Other publications Patents or other outputs Educational, MSc and PhD theses Facilities, instrumentation Prototypes, methodologies Networks Table 4.2 Main organisation and collaborating subunit Prof. Hannu Häkkinen, JYU, Nanoscience Center Prof. Ari Koskinen, AU Dr. Elina Kalenius, Univ. Eastern Finland, Joensuu Prof. Reko Leino, Åbo Akademi Univ., Turku Type of Collaboration and the field of science/Collaborator* Synthetic and computational chemistry/MN X-ray crystallography/KR, MN Mass spectrometry/KR, EK, MN Results Combined catalysis sequences/PP Refereed scientific publications on-going M.Sc. thesis, starting research collaboration refereed scientific publications refereed scientific publications 10 Dr. Reijo Aksela, Kemira Co., Finland Dr. Oili Kallatsa, PCAS Co., Finland Dr. Manu Lahtinen, JYU, Inorg. Chem. Synthesis of chelating agents/PP Asymmetric catalysis/PP Thermogravimetric analysis/KR, EK refereed scientific publications Refereed scientific publications Refereed scientific publications Prof. Robert Franzén, Techn. Univ. X-ray crystallography/KR Refereed scientific publications Prof. Jouni Pursiainen, Univ. Oulu X-ray crystallography/KR,MN Refereed scientific publications Prof. Johan Bobacka, Åbo Akademi X-ray crystallography, Synthetic chemistry/KR Refereed scientific publications Dr. Juho Helaja, Univ. Helsinki X-ray crystallography/KR Refereed scientific publications Prof. Pirjo Vainiotalo, Univ. Eastern Mass spectrometry, X-ray crystallography/ KR, EK Refereed scientific publications X-ray crystallography, Synthetic chemistry/KR Refereed scientific publications Prof. Jussi Valkonen, JYU, Inorg. Chem. X-ray crystallography/KR Refereed scientific publications Prof. Markku Kulomaa, IMT, Univ. Synthesis chemistry/KR Refereed scientific publications Synthetic chemistry, X-ray crystallography/KR Refereed scientific publications Refereed scientific publications Prof. Ilkka Kilpeläinen, Univ. Helsinki Halogen bonding, X-ray crystallography/KR Synthetic chemistry, NMR spectroscopy/EK Solid State NMR spectroscopy, X-ray crystallography/EK, KR Solid State NMR spectroscopy/EK Prof. Kalevi Pihlaja, Univ. Turku Dr. Jarmo Ropponen, VTT, Espoo NMR spectroscopy/EK Solid State NMR spectroscopy/EK Prof. Markus Ahlskog, Univ. Jyväskylä, Dept. Physics Synthetic chemisty, AFM technigues/TL,KR Prof. Matti Haukka, Univ. Eastern Crystal engineering/KR Network Synthetic chemistry/SI,EK Recently started common research project, no outcome yet Tampere Univ., Turku Finland, Joensuu Prof. Ari Ivaska, Åbo Akademi Univ., Turku Tampere Prof. Jouko Korppi-Tommola, JYU, Phys. Chem. Prof. Pierangelo Metrangolo, VTT, Helsinki Prof. Jouko Vepsäläinen, Univ. Eastern Finland. Kuopio Prof. Olli Ikkala, Aalto Univ. , Helsinki Refereed scientific publications, ms in preparation Refereed scientific publications, ms in preparation Refereed scientific publications, ms in preparation Refereed scientific publications Refereed scientific publications, ms in preparation common research project Finland, Joensuu Prof. Janne Ihalainen, University of Jyväskylä. Dept. Biology *Collaborators: KR = Kari Rissanen, EK = Erkki Kolehmainen, MN = Maija Nissinen, PP = Petri Pihko, TL = Tanja Lahtinen, SI = Satu Ikonen, JP = Jaakko Paasivirta 11 C. International collaboration List your most important international collaborations with the same criteria as in Section 4.B. Table 4.3 Main organisation and collaborating subunit Country Type of Collaboration and the field of science/Collaborator* Synthetic chemisty, X-ray crystallography/KR,MN X-ray crystallography/KR Results Prof. Antonella Dalla Cort, Italy UK Synthetic chemisty, X-ray crystallography/KR Germany Synthetic chemisty, X-ray crystallography/KR common research project, refereed scientific publications common research project Dalcanale, Italy Synthetic chemisty, X-ray crystallography/KR Dr. S. K. Chawla, Guru India X-ray crystallography/KR Germany Synthetic chemisty, X-ray crystallography/KR Univ. La Sapienza, Rome Prof. Carl Henrik Görbitz, Norway Univ. Oslo Dr. Jonathan Nitschke, Univ. Cambridge Dr. Arne Luetzen, Univ. Bonn Prof. Enrico Univ. Parma Nanak Dev Univ., Amritsar Prof. Markus Albrecht, Tech. Univ. Aachen Prof. Günter Haufe, Univ. Prof. Raj Pal Sharma, Panjab Prof. Jean-Pierre Sauvage, Prof. Giuseppe Resnati, Univ. Strasbourg refereed scientific publications X-ray crystallography/KR refereed scientific publications X-ray crystallography/KR refereed scientific publications X-ray crystallography/KR refereed scientific publications Hungary Adac. Scien., Budapest Prof. Anthony Davis, Univ. Bristol Prof. Jean-Marie Lehn, X-ray crystallography/KR Italy La Sapienza, Rome Dr. Istvan Moldvai, Hun. refereed scientific publications Italy Tech Univ. Milan Prof. Luigi Mandolini, Univ. X-ray crystallography/KR France Univ. Strasbourg UK common research project, refereed scientific publications refereed scientific publications X-ray crystallography/KR India University, Chanidgarh refereed scientific publications common research project, refereed scientific publications refereed scientific publications Germany Muenster refereed scientific publications NMR spectroscopy, X-ray crystallography/EK,KR,MN France X-ray crystallography/KR refereed scientific publications refereed scientific publications 12 Prof. Makoto Fujita, Univ. Tokyo Prof. Virgil Percec, Univ. of Pennsylvania Prof. Ola Wendt. Univ. Lund Japan Dr. Zoran Dzolic, RBI, Zagrab Prof. Enrigue GarciaEspana, Univ. Valencia Croatia Prof. Lars Öhrntröm, Chalmers Tech. Univ. Dr Roland Fröhlich, Univ. of Münster Prof. Chris A. Schalley, Freie Univ- Berlin Sweden Dr. H. Saxell, BASF SE Germany Dr. Patrick Shahgaldian, Fachhochschule Nordwestschweiz Prof. Jochen Mattay, Bielefeld University Prof. Benjamin List, MPI, Mülheim Switzerland Prof. Phil Baran, The Scripps Research Institute, Dept of Chemistry, USA USA Total synthesis of natural products/PP Prof. Georgios Vassilikogiannakis, University of Crete, Dr. K. V. Radhakrishnan, NIIST-CSIR / University of Kerala, Kerala, India Prof. Imre Papai, Hungarian Academy of Sciences, Hungary Prof. Jiri Brus, Inst. Polym. Chem., Prague Prof. Subramanian Chandrasekaran, Georgia State University Prof. Jerry Ray Dias, University of Missouri Prof. Pavel Drasar, Institute of Chemical Technology, Prague Greece Total synthesis of natural products/PP Postgraduate student visits India Asymmetric catalysis/PP Initiated research collaboration Hungary Computational studies in hydrogen bonding catalysis/PP NMR spectroscopy/EK Manuscript in preparation USA Sweden Spain Germany Germany Germany Germany Czech Republic Synthetic chemisty, X-ray crystallography/KR Synthesis chemisty/KR Synthetic chemisty, X-ray crystallography/KR Synthetic chemisty, X-ray crystallography/KR Synthetic chemisty, X-ray crystallography/KR Synthetic chemisty, X-ray crystallography/KR X-ray crystallography/MN,KR Mass spectrometry, X-ray diffraction, Synthesis chemistry/KR,MN Polymorphism, Solid State NMR spectroscopy/MN,EK Resesrch exchange, education/MN Synthetic chemisty, X-ray crystallography/MN Organocatalysis/PP USA 17 USA Synthetic chemistry, NMR spectroscopy/EK Synthetic chemistry, NMR spectroscopy/EK Czech Republic O NMR spectroscopy/EK Common res. project, 2009 started collaboration refereed scientific publications common res. project Publication in preparation common res. project Publication in preparation common res. project Publication in preparation common res. project Publication in preparation refereed scientific publications refereed scientific publications refereed scientific publications, patents Researcher exchange, starting research collaboration research collaboration Student exchange, ongoing collaboration in organocatalytic reactions Postgraduate student visits refereed scientific publications Initiated research collaboration refereed scientific publications Initiated research collaboration 13 Prof. Ryszard Gawinecki, University of Technology and Life Sciences, Bydgoszcz, Prof. Vladimír Král, Inst. Chem. Technol., Prague, Prof. Nikolai V. Lukashev, Moscow State University Prof. Uday Maitra, Indian Institute of Science, Bangalore Prof. Radek Marek, Masaryk University, Brno Prof. Mikiji Miyata, Osaka University Poland Synthetic chemistry, NMR spectroscopy, X-ray crystallography/EK refereed scientific publications Czech Republic refereed scientific publications refereed scientific publications refereed scientific publications Dr. T. Mohan Das, University of Madras Prof. Vladimir A. Nikiforov, St. Petersburg University Dr. Borys Osmialowski, University of Technology and Life Sciences, Bydgoszcz Dr. Pal Perjesi, University of Pecs Prof. Chebrolu Pulla Rao, Indian Institute of Technology, Mumbai India Synthetic chemistry, NMR spectroscopy/EK Synthetic chemistry, NMR spectroscopy/EK Synthetic chemistry, NMR spectroscopy, X-ray crystallography/EK,KR NMR spectroscopy, CSA tensor analysis/EK Solid State NMR spectroscopy, X-ray crystallography/EK Synthetic chemistry, NMR spectroscopy/EK NMR spectroscopy, X-ray crystallography/EK Synthetic chemistry, NMR spectroscopy, X-ray crystallography/EK Hungary NMR spectroscopy/EK India. NMR spectroscopy, X-ray crystallography/EK,KR refereed scientific publications refereed scientific publications Dr. David Šaman, Czech Acad. Sci., Prague Prof. Alexander G. Shavva, St. Petersburg University Prof. Vladimír Sklenár, Masaryk University, Brno Prof. Zdenek Wimmer, Czech Acad. Sci., Prague Prof. Eugenijus Butkus, Univ. Vilnius Prof. Toomas Tamm, Univ. Talinn Prof. Kenneth Wärnmark. Univ. Lund Prof. Andrew Bond, Univ. Odense Prof. Giulia Licini, Univ. Padova. dept. Chem. Dr. Michal Hocek, IOCB, Czech Academy of Science Dr. Charl Faul, Univ. of Bristol, Dept. Chem. Czech Republic NMR spectroscopy/EK Russia Synthetic chemistry, NMR spectroscopy /EK NMR spectroscopy/EK Russia India Czech Republic Japan Russia Poland Czech Republic Czech Republic Lithuania Estonia Sweden Denmark Italy Czech Republic UK Synthetic chemistry, NMR spectroscopy/EK Crystal engineering,. X-ray crystallography/KR Crystal engineering, X-ray crystallography/KR Crystal engineering, X-ray crystallography/KR Crystal engineering, X-ray crystallography/KR Synthetic chemisty, X-ray crystallography/KR Synthetic chemistry, biochemistry/SI X-ray crystallography/KR refereed scientific publications Initiated research collaboration Initiated research collaboration refereed scientific publications refereed scientific publications refereed scientific publications Initiated research collaboration refereed scientific publications refereed scientific publications Network Network Network Network common res. project Publication under review Common research project, refereed scientific publ. starting research collaboration 14 Prof. Jan Triska, Univ. of Budejovice Czech Republik. Bio-organic chemistry/JP refereed scientific publications *Collaborators: KR = Kari Rissanen, EK = Erkki Kolehmainen, MN = Maija Nissinen, PP = Petri Pihko, TL = Tanja Lahtinen, SI = Satu Ikonen, JP = Jaakko Paasivirta D. Visits abroad In the following, list only senior and postdoctoral researchers of Table 2.2. Do not include visits done by the listed persons during their postgraduate studies. Minimum duration of visit: one month. Table 4.4 Name Ngong Kodiah Beyeh Target organisation and visited subunit Country Period of visit Source of funding Freie Univ. Berlin, Dept. Chem. Germany 1.2. – 31.3.2009 Academy of Finland In the following, list the visits abroad made by postgraduate students. Visits shorter than one month are not taken into account. Table 4.5 Name Sara Busi Ngong Kodiah Beyeh Elisa Nauha Elisa Nauha Kirsi Salorinne Anniina Erkkilä Jatta Aho Antti Pohjakallio University and subunit Freie Univ. Berlin, Dept. Chem. Freie Univ. Berlin, Dept. Chem. BASF SE University of Münster University of Münster Max-Planck Institut für Kohlenforschung, Mülheim, University of Crete, Heraklion The Scripps Research Institute, Dept Chem. Country Period of visit Source of funding Germany 1.9. – 30.11.2006 Academy of Finland Germany 3.9. – 28.11.2007 Academy of Finland Germany Germany Germany Germany 1.12.08-30.6.2009 28.10.-27.11.2009 1.- 28.2.2006 1.10.2005-21.12.2005 BASF SE JYU Academy of Finland Academy of Finland Greece 1.10.2006-30.11.2006 COST D28 USA 1.4.2007-30.6.2007 Graduate School E. Visits to the Unit Include visiting professors, visiting senior researchers and visiting postdoctoral researchers when the funding has not been organised through the activities of your unit. Minimum duration of visit: one month. Do not include visiting researchers from section 2. A2. 15 Table 4.6 Name and title of the visitor Home organisation and visitor’s subunit Country Field of science Period of visit Source of funding NO VISITS In the following table list the visits to the unit made by postgraduate students from other universities irrespective of the funding source. Visits shorter than one month are not taken into account. Table 4.7 Name Jens Illigen Sascha Zhuxia Shu Mr. Alberte Veiga Ralf Troff Joao Figueira Joao Figueira Dominic Weimann Ralf Troff Joao Figueira University and subunit Univ. Bonn, Dept. Chem. Univ. Bonn, Dept. Chem. University of Santiago de Compostela Freie Univ. Berlin, Dept. Chem. Univ. Madeira, Dept. Chem. Univ. Madeira, Dept. Chem. Freie Univ. Berlin, Dept. Chem. Freie Univ. Berlin, Dept. Chem. Univ. Madeira, Dept. Chem. Country Period of visit Source of funding Germany 1.9. - 1.10.2005 DAAD Germany 4.8. - 14.12.2006 DAAD Spain 1.4. - 30.6.2007 Germany 20.8. - 18.11.2007 University of Santiago de Compostela DAAD Portugal 15.9. - 31.12.2007 FCT, Portugal Portugal 1..1. - 31.3.2008 FCT, Portugal Germany 10.9. - 10.11.2008 DAAD Germany 29.9. - 10.11.2008 DAAD Portugal 2.2. - 31.5.2009 FCT, Portugal F. Industrial collaboration In the following table list only such collaborations where senior and postdoctoral researchers listed in Table 2.2 have participated. Table 4.8 Collaborating organisation and subunit PCAS Finland Soligs, Abbott GmbH & Co Country Type of collaboration Results of collaboration Finland and France Germany Research collaboration in asymmetric catalysis Research collaboration in structural chemistry Refereed scientific publication Research report In the following, list cases where industrial collaboration has constituted an essential part of completed postgraduate studies. 16 Table 4.9 Collaborating organisation and subunit No collaboration Country Title of dissertation (From Table 3.3 ) In the following, list MSc theses done in industry. Table 4.10 Collaborating organisation and subunit BASF SE, Ludwigshafen Country Title of MSc thesis Germany KemFine Finland Bio-Tie Therapies Finland Santen MAP Medical Technologies Finland Finland Elisa Nauha: Polymorph screening of tiophanate-methyl Elsa Hukari: Optimization of an Aromatization Process Sari Norrlund, Design and Synthesis of non-peptide integrin inhibitors Niina Ketola, Bisanthrones Karoliina Nurminen, The Imaging of Brain Serotonin Transporters with Radiopharmaceuticals 5. OTHER SCIENTIFIC AND SOCIETAL ACTIVITIES Throughout this section include only senior and postdoctoral researchers of Table 2.2. Target the activities to the period of evaluation (2005-2009). Do not use acronyms of journals, conferences, institutions etc., but spell them out. Invited presentations in scientific conferences Table 5.1 Name Kari Rissanen Title of presentation Supramolecular Assemblies Through Weak Non-Covalent Interactions Petri Pihko Organocatalytic Tools for Asymmetric Synthesis Petri Pihko Organocatalytic Tools for Asymmetric Synthesis Petri Pihko Organocatalytic Tools for Asymmetric Synthesis Name of the conference COST D31 Symposium on “Organising Non-Covalent Chemical Systems with Selected Functions”, Leuven, Belgium, ERA-Chemistry Workshop 2006: Stereo-controlled chemistry related to the solution of major biological problems, Madrid, Spain CERC3 Workshop on Organocatalysis, Stockholm, Sweden International Symposium on Organocatalysis in Organic Synthesis, Glasgow, UK Year 2005 2006 2006 2006 17 Kari Rissanen Functional Dendrimers Petri Pihko Organocatalytic Tools for Asymmetric Synthesis Kari Rissanen Ion-Pair Recognition by Uranyl Salophens Kari Rissanen Supramolecular Assemblies Through Weak Non-Covalent Interactions Guanidine Based Hydrogen Bonded Networks Kari Rissanen Petri Pihko Petri Pihko Probing the Limits of Organocatalysis with Simple Catalysis Organocatalytic Tools for Synthesis Kari Rissanen Supramolecular Chemistry Kari Rissanen Multiple Interactions in Solid State Supramolecular Chemistry Kari Rissanen Weak Intermolecular Interactions in the Solid State, the Supramolecular Chemistry Perspective Tubular and Porous Materials from Rigid Macrocycles via Halogen Bonding Tools for the Asymmetric Synthesis of Polyketides Kari Rissanen Petri Pihko Nanotechnology in formulation, delivery & targeting of (biotechnological) drugs, Helsinki COST D28 Symposium “Natural Products as a Source for Discovery, Synthesis and Application of New Pharmaceuticals”, Santorini, Greece COST D31 Symposium on “Organising Non-Covalent Chemical Systems with Selected Functions”, Athens, Greece 7th International Conference on Optical Probes of π-Conjugated Polymers, Turku,. Finland MC8: Advancing Materials by Chemical Design, University College London, UK International Conference on Asymmetric Organocatalysis, Otsu, Shiga, Japan 15th European Symposium on Organic Chemistry (ESOC), University College Dublin, Ireland DAE-BRNS Basic Sciences School on Condensed Matter Interface with Chemistry and Biology, Homi Bhabha Centre for Science Education, Mankhurd, Mumbai, India Gordon Research Conference on Organic Structures & Properties, Lucca (Barga), Italy The Eighteenth Croatian-Slovenian Crystallographic Meeting, Varazdin, Croatia 2006 238th American Chemical Society National Meeting & Exposition, Washington DC, USA XXII Conference on Advances in Organic Synthesis (AOS), Karpacz, Poland 2009 2006 2007 2007 2007 2007 2007 2008 2008 2009 2009 Memberships in editorial boards of scientific journals. Table 5.2 Name Kari Rissanen Kari Rissanen Erkki Kolehmainen Journal New Journal of Chemistry CrystEngComm Molecules (Bile acids: Special Issue Editor) Period 2000 -> 2003 - 2008 2007- 2008 18 Representatives in international scientific boards, committees, and equivalent. Table 5.3 Name Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Erkki Kolehmainen Erkki Kolehmainen Maija Nissinen Maija Nissinen Maija Nissinen Maija Nissinen Petri Pihko Petri Pihko Kari Rissanen Board etc. and task Chairtman Committee of the COST Chemistry Action D31 (Organising Non-Covalent Chemical Systems with Selected Functions), 2004 - 2009 Management Committee of the COST Chemistry Action D31 (Organising NonCovalent Chemical Systems with Selected Functions), 2004 - 2009 Member of the Scientific Committee of Finnish Chemical Indistry Member of the Research Council for Natural Sciences and Engineering of the Finnish Academy, Chairman of the Steering Committee of the Academy of Finland nanoscience research programme, FinNano Member of the Steering Committee of the Academy of Finland nanoscience research programme, FinNano Member of the Science Council of the University of Jyväskylä Member of TEKES FinNano Chemical Industries vision workgroup Chairman of the 15th and 16th Jyväskylä International Summer School Period 2004 - 2005 Course coordinator for 17th - 19th Jyväskylä International Summer School Scientific evaluator in EC FP7 Marie Curie IOF, IIF and EIF panel Scientific evaluator in EC FP6 Marie Curie IOF, IIF and EIF panel Scientific evaluator in EC FP7-NMP-SMALL panel Member of Management Committee of COST MP0701 Management Committee Member of COST Action CM0804 “Chemical Biology with Natural Products” Management Committee Member of COST Action CM0905 “Organocatalysis” Member of International Advisory Committee (IAC) of the Doctoral School "Vito Volterra". University La Sapienza, Rome, Italy 2007 - 2009 2005 - 2009 2002 -2007 2004 –2006 2005 - 2006 2007 -> 2006 - 2009 2006 2005 – 2006 2008 2006-2007 2008-2009 2008-> 2009-> 2008-> 2009-> Prizes awarded to researchers, honours, scientific positions of trust, and equivalent. 19 Table 5.4 Name Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Kari Rissanen Pihko Petri Pihko Petri Sami Nummelin Erkkilä Anniina (TKK) Jatta Aho (TKK) Prize, position etc. Knight, First Class, of the Order of the White Rose of Finland (SVR R 1), 2008 Magnus Ehrnrooth Prize in Chemistry, Societas Scientiarum Fennica, 2005 Fellow of the Royal Chemical Society, 2005-> Member of Finnish Academy of Science and Letters, 2004 -> Member of Academia Europaea, 2008 -> Helsinki University of Technology: Outstanding Junior Research Group, 20042005 Thieme Journal Award, 2007 The 2008 Ph.D. thesis award of The Society for Wood and Polymer Chemistry in Finland Publication Prize of the Division of Synthetic Chemistry, Association of Finnish Chemical Societies, 2007 Publication Prize of the Division of Synthetic Chemistry, Association of Finnish Chemical Societies, 2007 Representatives in committees and in scientific advisory boards, companies, or other similar tasks of not primarily academic nature. Table 5.5 Name - Company, board etc. and task Period PART II THE UNIT’S SELF-ASSESSMENT A. Describe the Unit’s research and strategy (max. 2 pages) A. 1 Unit’s research Since its foundation in the late 1960’s the Department of Chemistry of University of Jyväskylä has had structural chemistry in its all variations as the main research theme across all laboratories of the department. The unit (organic chemistry) led by Professor Jaakko Paasivirta was the leading site for chemistry oriented NMR research and education in Finland in the 1970’s. In the middle of 1980’s Prof. Paasivirta made the major chance in his research profile as he focused into environmental analytics, especially to ecotoxicology. He still (after his retirement in 1994) is one of the most cited scientists in the category ecology/environment in the ISI highlycited.com. The unit experienced the third research profile change in 1995 when Professor Kari Rissanen (currently academy professor) started in the unit. With him the profile of the unit was shifted toward supramolecular chemistry, especially to solid state structural as well as synthetic supramolecular chemistry. This profile was further reinforced by a very strong NMR research group led by Professor Erkki Kolehmainen, who started as a professor in 2001. The activities of both Rissanen and Kolehmainen led to a marked increase both in the publication output as well as in the number of high standard international collaborations (see item II.F). 20 Since 1995 unit has had a major role on the study of nanosized molecules and supramolecular assemblies within the Faculty of Mathematics and Science and thus the unit had a major impact on the foundation of the Nanoscience Center at the University of Jyväskylä (NSC). Since the start of the NSC in 2003 the unit has been, together with the theoretical research groups, a major contributor of the scientific output of the NSC. In 2005 a new 5-year term professorship on “Synthetic chemistry of hybrid materials” at the NSC was founded and in JAN 2006 Dr. Maija Nissinen started in this position. Prof. Nissinen originates from the unit (Ph.D. in 2001) and her scientific work and education duties are elemental part of the activities of the unit. The department has in early 2010 decided to tenure Prof. Nissinen’s position. Due to the Academy professorship of Dr. Rissanen in 2008–2012, Dr. Petri Pihko was nominated as a professor for Prof. Rissanen’s leave of absence. Dr. Pihko started in April 2008 and built up a research group focusing on total synthesis of natural products, organocatalysis and the development of synthetic methods. The research profile of Dr. Pihko is complementary to the more structurally oriented groups of Rissanen, Kolehmainen and Nissinen and reinforces significantly the research profile and output of the unit. In addition to the four professors the unit has three senior scientist research groups, namely Academy Research Fellow Elina Sievänen, University Lecturer Juhani Huuskonen and Senior Teaching Assistant Tanja Lahtinen. Of these three groups Dr. Sievänen is connected, yet being independent, with the Kolehmainen group, while both Dr. Huuskonen and Dr. Lahtinen affiliate to the Rissanen group. The research profiles of each group are shortly summarised below. Rissanen: X-ray crystallography based studies on supramolecular structures and weak intermolecular interactions, synthetic chemistry of resorcinarenes and related cyclophane hosts; anion receptors based on uranyl salophens; new ligands for self-assembling Fujita-type nanopheres and -cages; small polyester dendrimers/dendrons and organoiodide compounds. The interaction studies in the solid state (single crystal X-ray diffraction, SS NMR), in solution (NMR) and in gas phase (mass spectrometry) are targeted to halogen and hydrogen bonding, transition metal ion coordination chemistry, cation-π, anion-π, C-H-π, hydrophobicity, dispersion and packing forces in order to understand the principles behind these interactions and to use them in the design and construction of novel supramolecular systems. Kolehmainen: Design, synthesis and structural characterization (NMR, MS, X-ray, thermoanalysis, molecular modeling, microscopies) of bile acid and other steroid derived conjugates and receptors, prodrugs, hydro- and organogelators etc. An especial goal is to develop prodrugs with improved bioavailability where a drug molecule bound with natural bile acid is introduced into liver via enterohepatic circulation. As the most recent approach is the research of polymorphs, solvates and co-crystals (with drugs) of bile acids and their derivatives by solid state NMR, powder and single crystal X-ray diffraction and thermal analysis. The ultimate goal in this research is to develop pharmaceutically and medically useful compounds and preparations. Nissinen: Synthetic chemistry of novel resorcinarene, pyrogallarene and calixarene derivatives, especially bridged and podand derivatives, which possess enhanced receptor properties. The receptor, i.e. complexation properties and interactions, as well as detailed structural and conformational features are investigated by means of NMR spectroscopy, X-ray crystallography, UV-vis spectroscopy and mass spectrometry, which is the other main focus of the research group and complements the structural chemistry oriented research profile of the whole unit. The third important part of the research profile is the polymorphism, solvate and co-crystallization studies, 21 especially with industrially significant compounds, such as agrochemicals. Pihko: Total synthesis of natural products and the development of synthetic methods. Current natural product targets of interest include the marine toxin pectenotoxin-2 (PTX-2), bearing a nonanomeric spiroketal, as well as smaller polyketides. Our synthetic methodology focuses on utilization of organocatalysis in synthesis; the focus has been on amine catalysis but is gradually shifting towards hydrogen bond catalysis, as well as redox catalysis, especially catalytic hydrogenation and oxidative coupling methods. Sievänen: Development of smart andfunctional supramolecular gels derived from bile acids. This is established by synthesizing new bile acid-derived molecules with thepotential to act as low molecular weight gelators and characterizing the structures of the synthesized molecules in detail. The ability of the prepared molecules to promote gel formation is systematically investigated, the structures and properties of the formed gels examined, and the potential applications of the gels charted. The versatile collection of analytical tools used includes NMR, IR, and CD spectroscopy, X-ray crystallography, mass spectrometry, microscopic techniques, as well as thermoanalytical methods combined with theoretical studies. The ultimate goal of the research is to understand the process of gel formation. Huuskonen: Design, synthesis and structural characterization (NMR, mass spectroscopy, X-ray, elementar analysis) of small bioactive molecules for inhibiting protein-protein interactions. Proteinprotein interactions are pivotal in most biological processes and thus represent an appealing target for innovative drug development and one goal in this research is to find new potential anticancer agents. Another goal is to develop microwave synthesis methods to produce molecule libraries faster for biological testing. Lahtinen: The design and synthetic chemistry of ionic liquids, mass spectrometry based complexation studies of supramolecular complexes and assemblies. Utilization of weak supramolecular interactions in the modification of carbon nanotubes and graphene (in collaboration with NSC physics group). The whole unit consists presently (15.2.2010) of 4 professors, 12 senior or post doc. researchers, 19 post graduate (Ph.D.) students, 10 graduate (M.Sc.) students and 9 undergraduate (B.Sc.) students and 3 laboratory technicians, a total of 57 person count, out of which 36 are full-time. A. 2 Unit’s strategy The strategy of the unit is to further strengthen the scientific output, impact and visibility to become the leading unit in organic and supramolecular chemistry in Northern Europe. The present high level in research and education coupled with the diversity in research expertise and the multicultural research environment are the key features of the unit and they will be exploited to attract young talented researchers (students, postdocs) into the unit. The yet quite modest collaboration within the NSC and other UJ departments will be given a high prority and the group-to-group collaborations within the unit itself, taking advantage of the complementary skills in full, will be taken into full action. Special attention is given to the tutoring and guidance of the domestic and international students and researchers in all levels. The research infrastructure will be maintained at the present high level and all means to further improvement in the instrumentation and operational skills will be utilized. The unit is an active actor in the Chemistry Department aim to be the leading educational institute in Chemistry in 2012. 22 B. SWOT – evaluation of the Unit’s scientific strengths, weaknesses, opportunities and threats (expertise, funding, facilities, organisation; max. 2 pages). Strengths - excellent international level in structural chemistry, especially in solid state (single crystal X-ray diffraction, NMR) and solution (NMR) - excellent international level in synthetic chemistry, especially in enantioselective total synthesis of natural products -extremely active and productive international and national collaboration with the leading research groups - participation to nanoscience research via the NSC and collaborations with nanophysics and nanobiology research groups - co-existence of senior and younger research groups - very good research facilities and infrastructure - very publication record both in quantity and quality - broad spectrum of publishing forums - the high level of the in-house educated Ph.D. students - multi-cultural research environment (at present 8 nationalities) Weaknesses - dependency on external funding - research facilities and infrastructure based possibilities for joint research is not fully employed - too specialized and purely academic research using very expensive instruments - difficulties in motivating contemporary chemistry students - industrial and commercial applications of the chemistry are largely missing - weak research and education in qualitative and quantitative analytical organic chemistry - societal impact and public visibility could be stronger - low success-rate for EU and other international funding - slowness to adapt to reforms and react to changes - very cumbersome and tedious patenting process due to weakly developed UJ IPR policies Opportunities Threats - integration of structural, supramolecular and synthetic chemistry could result in breaththoughs in new supramocular and other materials, in organic and organometallic catalysis and in bioactive substances - extension of interdisciplinary and multidisciplinary collaboration, especially to nanophysics, nanobiology and clinical sports medicine - utilization of international students and post docs in the teaching and mentoring within the unit. - multidisciplinary education at M.Sc. level with other laboratories and departments - commercializing potential of some areas of the research, especially bile acid related compounds - the maintenance and upgrading of the research infrastructure (NMR, MS, X-ray diffraction equipments) - the imbalance between the growing administrative duties and time for research - insecurity of external funding and lack of proper budget funding - the drop-out rate of undergraduate students - large amount of unmotivated or escaping students (to other disciplines) - lack of in-house educated M.Sc’s for postgraduate studies - dimishing or ceasing interest of international post docs and students to apply to unit - lack of significant chemical industry and job opportunities in the Central Finland area - the negative image and job prospects in chemical industry The major strengths of the unit associates with the level of the research quality, quantity and knowhow, the level of international and national collaborations and the connection to the nanoscience research. The major weaknesses relate to the dependence of the research on the external funding and the insecurity of it. The mainly academic research coupled with weak societal impact can also be considered a weaknes of the unit. The major opportunity is the possibility to join the excellent expertise within the unit supplemented by the nanoscience groups into an innovative yet academically very high standard research environment focusing of the most topical areas of 23 contemporary chemistry and nanoscience. Major threats associate with the true fear that the previously well-organized system for maintenance and upgrading of the research infrastructure will be ruined by the new legal status of the Finnish Universities and that it will later severely decimate both the quality and quantity of the current high standard of research. C. Assess the research infrastructure available (max. 1 page) The unit has excellent facilities and research equipment at the Department of Chemistry, University of Jyväskylä. Three NMR equipments (Bruker DPX-250, Avance 400 (solid state) and DPX500 MHz) coupled with two very modern X-ray diffractometers (Bruker-Nonius Kappa APEXII with Mo and Cu radition and Oxford Cryosystem liquid nitrogen cooling), three mass spectrometers (ESI-MS/MS (AB Qstar Elite), ESI-TOF (Micromass LCT) and MALDI-TOF (Micromass LYNX)), elemental analysis equipment (ELEMENTAR Analysensysteme Vario EL) provide the solid basis for the structural characterisations. The analytical and chemical reaction equipment include GC-MS and GC (Perkin-Elmer Clarus 500+560S and Agilent 7890A), IR spectrophotometer (Bruker Tensor 27), Polarimeter (PerkinElmer 341B), Ozoniser, (Pacific Technologies G21), two HPLC’s [Shimadzu LC-8A with FRC10A fraction collector, SPD-M20A diode array detector and SIL-10AP autosampler, and Waters 616 pump, 600S controller, 2847 detector and 717 Autosampler)], CombiFlash-system (Teledyne ISCO), microwave reactor (CEM Discovery S class), cooling device (Neslab CC100) and dry solvent facility (MBrayn SPS800). Collaboration with inorganic chemistry laboratory allows access to methods for the analyses of the thermal behavior of the prepared molecules and assemblies (TG, DSC, TDA, powder diffractometers) and collaboration with the physical chemistry laboratory will provide means for photophysics and advanced optical spectroscopy studies (several femto-second laser systems, IR-, CD, UV-vis and Raman spectrometers) as well as for efficient utilization of computational resources of the University and on the national level. Excellent microscopic facilities (TEM, SEM, STM, SNOM, AFM, confocal) and other specialized equipment for (particle size analyzator, vacuum avaporators, CVDs etc) for nanochemistry research are available via collaboration with Nanoscience Center (NSC). Instrumentation for measuring nano-electrical, structural, mechanical, acoustic, thermal and magnetic properties in low temperatures are also available at NSC. Modern synthetic laboratories at the Department of Chemistry and at Nanoscience Center (space enough to accommodate 20 - 30 graduate and undergraduate students as well as post doctoral researchers) are adequately equipped and already in effective use with the current members of the unit. D. Most important publications Rissanen: 1. P. Mal, B. Breiner, K. Rissanen and J. R. Nitschke, White Phosphorus is Air-Stable within a Self-Assembled Tetrahedral Capsule, Science 324 (2009), 1697 - 1698. In this paper we were able to show unambiguously that white phosphorus, viz. P4 molecules were encapsulated within the container molecules prepared by the Cambridge team and structurally characterized in Jyväskylä. Within these capsules, the phosphorus becomes air stable for months. 24 Even being tightly bound it is possible to release the encapsulated P4 by the addition of a competing guest, benzene. Once removed, the white phosphorus regains its air-sensitivity, rapidly reacting with oxygen if present. This work thus provides a novel way to handle white phosphorus safely, and a potentially new means of stabilizing similar very sensitive and reactive chemicals from the environment, and conversely, protecting the environment from hazardous substances. 2. P. Metrangolo, Y. Carcenac, M. Lahtinen, T. Pilati, K. Rissanen, A. Vij and G. Resnati, NonPorous Organic Solids Capable of Dynamically Resolving Mixtures of Diiodoperfluoroalkanes, Science 323 (2009), 1461 – 1464. The chemical separations using porous solids mostly rely on size selection, meaning that compounds too large to squeeze through the pores are excluded. The current paper describes a class of ionic solids that can selectively capture certain fluorocarbons dynamically. The crystals comprise dicationic hydrocarbon chains capped at each end by positive ammonium groups, with negative iodide ions to balance the charge. Although structurally nonporous, the solids spontaneously stretch to accommodate iodine-capped fluorocarbon chains, which form robust intermolecular halogen bonds with iodides at each end. In other words, the solids used behave like a sponge that can absorb a specific molecule. This encapsulation is highly selective for the fluorocarbon, with a chain length scaled to the lattice dication. Moreover, the process is reversible, with the guests liberated by heating, offering potential for use in industrial fluorocarbon separations. 3. S. S. Zhu, H. Staats, K. Brandhorst, J. Grunenberg, F. Gruppi, E. Dalcanale, Arne Lutzen, K Rissanen and C. A. Schalley, Anion Binding to Resorcinarene-Based Cavitands: The Importance of C–H···Anion Interactions, Angew. Chem. 47 (2008), 788 - 792. This paper shows with very sophisticated mass spectrometry studies that the interaction strength between host and guest anion can amount to substantial values. From a fundamental point of view, this study provides new insight into the nature and importance of C-H···anion interactions. This mode of hydrogen bonding, that is, hydrogen bonds between an anion and a nonaromatic C-H bond, is very rare and was not well studied before this paper and we were able to show that neutral cavitands complex different anions exclusively through this type of weak interaction. 4. P. Mal, D. Schultz, K. Beyeh, K. Rissanen and J.R. Nitschke, An Unlockable-Relockable Iron Cage via Subcomponent Self-Assembly, Angew. Chem. 47 (2008), 8297 – 8301. This paper demonstratest the first time reversible locking and unlocking by the tetrahedral cage formed in water by a linear diamine, formylpyridine, and iron(II). Addition of acid unlocks the cage, releasing the hydrophobic guest molecule, and subsequent addition of base relocks it. A triamine can be used to dismantle the tetrahedral host structure. 5. M. Albrecht, C. Wessel, M. de Groot, K. Rissanen and A Lüchow, Structural Versatility of Anion- Interactions in Halide Salts with Pentafluorophenyl Substituted Cations, J. Am. Chem. Soc. 130 (2008), 4600 - 4601. In this paper we presented the first systematic solid state structural approach to “metal-free” salts, which contain pentafluorophenyl as a substituent and which exhibit extensive anion-π interactions. 25 We observed anion-donor-π-acceptor as well as “η6” anion-π-complex type interactions. The latter kind was also proven by high level quantum chemical calculations and showed the strong attraction due to anion-π interaction in addition to hydrogen binding. Based on our studies we were able to add a new “η2”-type binding mode as an additional alternative, in which the anion is not located above the center of an aromatic ring and does not interact with only one specific carbon atom of the π-system, to the yet elusive anion-π interactions. 6. N. K. Beyeh, M. Kogej, A. Åhman, K. Rissanen and C. A. Schalley, Flying Capsules: Mass Spectrometric Detection of Pyrogallarene and Resorcinarene Hexamers, Angew. Chem. Int. Ed. Engl. 45 (2006), 5214 - 5218. Here we present for the first time evidence that the hydrogen-bonded pyrogallarene and resorcinarene hexamers can be successfully ionized and transferred into the high-vacuum of a mass spectrometer. The comparison of different guest cations which provide the charge clearly show that the size, shape, and symmetry of the guest are important features for an efficient generation of hexamer ions with a capsule structure. Evidence for a capsular structure even in the gas phase after ionization comes from IRMPD experiments with mass-selected hexamer parent ions. Our results not only indicate the stabilizing influence of suitable templating cations, they also point to the remarkable intrinsic softness of electrospray ionization mass spectrometry, which permits their characterization in the gas phase as isolated molecules without the influence of solvents and counterions. 7. M. Cametti, M. Nissinen, A. Dalla Cort, L. Mandolini and K. Rissanen, Recognition of Alkali Metal Halide Contact Ion Pairs by Uranyl-Salophen Receptors Bearing Aromatic Sidearms. The Role of Cation--Interactions. J. Am. Chem. Soc. 127 (2005), 3831-3837. The results presented in this paper, in addition to our previous results of tetralkylammonium halide complexation, show that certain uranyl salophen complexescan be quite adaptable as a receptor, in that upon guest complexation its conformationally flexible sidearms adapt to achieve a stable arrangement, in which multiple CH-π or cation-π interactions are established. The sidearm positions and, consequently, the molecular and crystal structures of the resulting complexes are controlled by interactions of the aromatic sidearms with the different guests. This work has opened the way toward the development of novel zwitterion receptors and in the recognition of a number of zwitterions, including betaine and related compounds and phospholipids. 8. K. Raatikainen, J. Huuskonen, M. Lahtinen, P. Metrangolo and K. Rissanen, Halogen bonding drives the self-assembly of piperazine cyclophanes into tubular structures, Chem. Comm. (2009), 2160 - 2164. In this paper we show that a preorganized rigid ring shape with strong halogen bonding (XP) acceptor sites offers an excellent way to organize molecules into desired tubular/porous architectures via halogen bonding. Our results demonstrate that the use of XB with larger and rigid macrocycles will lead to formation of porous organic materials and also to a better understanding of the potential role of halogen bonding as an important interaction in crystal engineering and materials chemistry. 26 Kolehmainen: 1. O. Jurček, Z. Wimmer, H. Svobodová, B. Bennettová, E. Kolehmainen, and P. Drašar, Preparation and preliminary biological screening on cholic acid-juvenoids conjugates, Steroids 74 (2008), 779 – 785. Synthesis and biological testing of bile acid derivatives aimed for pest control. 2. Nonappa, M. Lahtinen, S. Ikonen, E. Kolehmainen, and R. Kauppinen, Solid state NMR, X-ray diffraction and thermoanalytical studies towards the identification, isolation and structural characterization of polymorphs in natural bile acids, Crystal Growth & Design 9 (2009), 4710 – 4719 Characterization of natural bile acid polymorphs for pharmaceutical use. 3. N. V. Lukashev, A. V. Kazantsev, A. D. Averin, M. S. Baranov, P. A. Donez, E. Sievänen and E. Kolehmainen, Novel macrocyclic bile acid derivatives. Selective and easy binding of two cholic acid moieties at 3 and 3’ positions, Synthesis (2009), 4175 – 4182. Improved synthesis of bile acid derived macrocycles, which can act as anion/cation receptors. 4. V. Noponen, S. Bhat, E. Sievänen, and E. Kolehmainen, Novel two-step synthesis of gold nanoparticles capped with bile acid conjugates, Mat. Sci. Eng. C., 28, (2008), 1144 – 1148. Improved synthetic procedure to prepare bile acid capped gold nanoparticles for drug targeting. 5. E. Sievänen, V. Noponen, E. Kolehmainen, V. Král, and T. Břiza, 1H, 13C, 19F NMR and ESI mass spectral characterization of two geminal difluorosteroids. Magn. Reson. Chem., 46, (2008), 392 – 397. Improved synthesis of geminal difluorosteroids aimed for medical applications. 6. J. Králová, V. Král, J. Koivukorpi, Z. Kejík, P. Poučková, P. Martasek, E. Sievänen and E. Kolehmainen, Porphyrin - bile acid conjugates: from saccharide recognition in solution to selective cancer cell fluorescence detection, Org. Biomol. Chem. 6 (2008), 1548 - 1552. Bile acid derivatives aimed for cancer diagnosis/therapy and other medical applications. 7. A. Valkonen, M. Lahtinen, and E. Kolehmainen, Syntheses and structural study of bile acid amidoalcohols, Steroids 73 (2008), 1228 – 1241. Liquid state and crystal structure characterization of novel bile acid derivatives, which can act as gelators and drug carriers. 8. T. Bartl, Z. Zacharová, P. Sečkářová, E. Kolehmainen, and R. Marek, Experimental NMR quantification of tautomeric populations in biogenetic purine bases, Eur. J. Org. Chem. (2008), 1377 - 1383. A long-term collaboration on tautomerism research of nucleobases with the group of prof. Marek. 27 Nissinen: 1. K. Salorinne, T.-R. Tero, K. Riikonen and M. Nissinen: Synthesis and structure of mono-bridged resorcinarene host: Ditopic receptor for ammonium guests, Org. & Biomol. Chem. 20 (2009), 42114217. Synthesis and properties of a ditopic receptor for organic cations is described. A unique type of receptor molecule, which has a lot of potential for on-going further studies and which has awoken interest on international level (the poster of this topic was awarded as the best poster, already cited although the article was published in late 2009). 2. K. Salorinne and M. Nissinen, Synthesis, Characterization and Complexation Properties of Tetramethoxy Resorcinarene Bis-Crown-Ethers, Org. Lett., 8 (2006), 5473-5476. Starting point of the research of a novel class of supramolecular hosts. This research has later produced seven original publications (including an invited review article) and will produce several more within a next few years. 3. K. Salorinne and M. Nissinen, Alkali Metal Complexation Properties of Resorcinarene BisCrown Ethers: Effect of the Crown Ether Functionality and Preorganization on Complexation, Tetrahedron 64 (2008), 1798-1807. A link between earlier alkali metal complexation studies and applications of novel bis-crown ether hosts. The research has raised international and national interest and further collaboration research is currently underway. 4. A. Åhman and M. Nissinen, Pyrogallarenes as alkali metal receptors: The role of cation-π interactions for complexation, Chem. Comm. (2006), 1209-1211. The first and rare examples of conformational change and alkali metal complexation of unfuctionalized resorcinarene-type hosts. 5. E. Nauha, H. Saxell, E. Kolehmainen, R. Schlecker and M. Nissinen, Polymorphism and versatile solvate formation of tiophanate-methyl, CrystEngComm 11 (2009), 2536-2547. Another main research area of group Nissinen done in close collaboration with international industry. Two more publications of the same research theme will be submitted in March 2010. Significant relevance in polymorphism and solvate study of agrochemicals and pharmaceuticals. 6. K. Salorinne, D. P. Weimann, C. A. Schalley and M. Nissinen, Resorcinarene podand with amine functionalized side arms – synthesis, structure and binding properties of a neutral anion receptor, Eur. J. Org. Chem. (2009), 6151-6159. Novel anion receptor was synthetised and its properties investigated. 28 7. K. Salorinne and M. Nissinen, Twisting of the resorcinarene core due to solvent effects upon crystallization, CrystEngComm 11 (2009), 1572-1578. Novel resorcinarene conformations were found and fully characterized and their formation mechanism was studied. Relates to another main research area of the group, i.e. solid state structural chemistry. 8. K. Helttunen, P. Prus, M. Luostarinen and M. Nissinen, Interaction of aminomethylated resorcinarenes with rhodamine B, New J. Chem. 33 (2009), 1148-1154. New insights of interactions between supramolecular hosts and organic dyes. Pihko: 1. A: Pohjakallio and P.M. Pihko, Enantioselective Synthesis of 2-Isoxazolines by an One-Flask Conjugate Addition – Oxime Transfer Process, Chem. Eur. J. 15 (2009), 3960-3964. A highly useful protocol is presented for the enantioselective synthesis of 2-isoxazolines from acetone oxime and α,β-unsaturated aldehydes. A full paper on this protocol, with improved yields and enantioselectivities, is in progress. The resulting isoxazolines can also be readily converted into chiral β-hydroxynitriles without loss of enantiomeric purity. A manuscript on this protocol is also under preparation. 2. L. Evanno, J. Ormala and P.M. Pihko, A highly enantioselective access to tetrahydroisoquinoline and β−carboline alkaloids with simple Noyori-type catalysts in aqueous media, Chem. Eur. J. 15 (2009), 12963-12967. A highly practical protocol for accessing a variety of tetrahydroisoquinoline and b-carboline skeletons, including two natural products, harmicine and cripsine, under mild aqueous conditions. In contrast with previously published protocols, this method avoids the use of specially prepared ligands, and also expands the scope of the reaction with lanthanide activation of the substrate. This research was carried out in its entirety on industrial support. 3. H. Helmboldt, J. Aho and P.M. Pihko, Synthetic Studies Toward Pectenotoxin 2. Part II. Synthesis of the CDE and CDEF Ring Systems, Org. Lett. 10 (2008), 4179-4182. Our strategy towards the synthesis of the pectenotoxin skeleton is described, including the assembly of the nonanomeric AB spiroketal ring system. This strategy was successfully applied to the synthesis of C10-epi-ABCDE ring system of pectenotoxin-2 (Ph.D. Thesis of Jatta Aho, http://lib.tkk.fi/Diss/2009/isbn9789522480767/) 4. A. Erkkilä and P.M. Pihko, Rapid Organocatalytic Aldehyde-Aldehyde Condensation Reactions, Eur. J. Org. Chem. (2007), 4205-4216. Full details as well as an improved, highly chemoselective and mild protocol for α-methylenation of aldehydes bearing a variety of functionalitie are reported. We also report full kinetic studies that probe the reaction mechanism, demonstrating that the reaction is 2nd order with respect to the catalyst, in contrast to the conventionally accepted mechanism of the Mannich reaction. 29 5. A. Erkkilä and P.M. Pihko, Mild Organocatalytic α-Methylenation of Aldehydes, J. Org. Chem. 71 (2006), 2538-2541. This is our first-generation α-methylenation paper. This protocol has been used by a number of synthetic research groups worldwide. E. Evaluate the Unit in relation to its leading scientific competitors (max. 1 page). Maybe the best and most unbiased way to compare the UJ organic chemistry laboratory to its national competitors is to use Institute of Scientific Information (ISI) Web of Knowledge (WoK) publication and citation records. The analysis (see below) was done using two different, yet complementary, methods. Firstly an ISI WoK search for amount of publications and their citations (Table II.1.) for the 10-year period (years 2000 – 2009) for the active professors (based in the Academy of Finland units to be evaluated list). Secondly the number of publications in the high impact factor journals (the 47 journals in all areas of chemistry with highest impact factors, min. IF = 4.147) of the same professors during 2000 – 2009 was analyzed (Table II.1, third column). To compare the units’ performace in relation to all evaluated chemistry units, the same analysis was made for the leading units in other areas of chemistry, for this the six other units at the Helsinki University (UH) were selected and the results are presented in the table II.1 below the organic chemistry units. The comparison of UJ organic chemistry to the UH units in inorganic, analytical, Swedish speaking, physical, polymer and radiochemistry units clearly reveals that UJ organic chemistry is, together with the inorganic chemistry laboratory of UH, the leading national chemistry unit when compared to the publication amount, impact and quality from the ISI Web of Knowledge for the 10-year period 2000 - 2009. The reader has to keep in mind that the present analysis gives a very narrow, yet unbiased, view of the status of UJ organic chemistry in relation to organic and other units in chemistry in Finland. Table II.1 Publication and citation analysis for 2000 - 2009 Unit (Professors) Number of publications UJ (Rissanen, Kolehmainen, Nissinen, Pihko, Paasivirta) UH (Wähälä, Kilpeläinen, Oivanen) UEF (Rouvinen, Jänis, Vainiotalo)* ÅA (Leino, Sjöholm) UT2 (Lönnberg, Salminen)** HUT (Koskinen, Jokela) UO (Hormi, Lajunen) TUT (Franzen) 391 171 135 112 115 90 42 11 UH, Inorg. chem (Leskelä, Ritala, Repo) UH, Anal. chem. (Riekkola, Kotiaho) UH, Swed. chem. (Pyykkö, Sundholm) UH, phys. chem. (Halonen, Räsänen) UH, polym. chem. (Tehnu, Maunu) UH, radiochem. (Lehto) 326 222 158 149 123 17 Number of high impact publications 79 Number of citations h-index 4943 32 10 10 15 6 10 4 0 2384 1239 1175 942 864 214 111 27 18 20 17 14 7 4 60 46 40 18 5 0 4531 3530 3207 2372 2092 150 33 30 28 25 25 6 * Prof. P. Vainiotalo included since she was active during 2000 – 2009 (retired DEC 2009) ** Prof. O. Solin is left out from this analysis, since he is a radiochemist, not organic chemist 30 The publication and citation analysis unambiguously reveals that UJ is the leading organic chemistry laboratory in Finland. The UJ unit itself makes up 37% of all publications published by the organic chemistry units, 59% of the high impact publications and 42% of total citations over the period of 2000-2009. In all fields of chemistry the UJ organic chemistry is a leading chemistry unit together with UH inorganic chemistry. F. Collaboration (max. 2 pages) The international and national collaborations of the unit are extremely extensive and strong as witnessed by the tables 4.2 ands 4.3 above. Each research group has their own collaborators, but there are a few collaborators which do collaborate simultaneously, yet independently, with different groups of the unit. There is also active group-to-group collaboration within the unit resulting in joint publications. The Rissanen group collaborations can be categorized into structural (utilizing single crystal X-ray diffraction, NMR or MS technigues), synthetic (synthesis done in UJ), exchange (M.Sc., Ph.D. and post doc. levels) and networking collaborations. Due to special expertise on the X-ray crystallography on large supramolecules and assemblies in the Rissanen group, the most numerous and productive collaborations are in the area of structural chemistry. The long-standing (> 10 years) structural collaborations with Nobel-laureate J.-M. Lehn (rotaxanes, grids, helicates); A. Dalla Cort and L. Mandolini (ditopic receptors); E. Dalcanale (cavitands); M. Albrecht (anion recognition, anion-pi interactions), being the most important and have been very successful and produced over the years 38 joint publications (among them 4 Angew. Chem., 1 PNAS, 4 JACS, 3 CEJ and 2 Chem. Comm.). The more recent impost structural collaborations involve J.-P. Sauvage (rotaxanes); J. Nitschke (cages, helicates); G. Resnati (halogen bonding) and have since 2007 resulted in 11 very high standard publication (2 Science, 1 Angew. Chem., 1 JACS, 2 CEJ and 1 Chem. Comm.). The most important and very recent synthetic chemistry collaborations include V. Percec (denrons); M. Fujita (nanospheres); U. Maitra (gelators); E. Dalcanale and A. Luetzen (cavitands), some of these collaborations have started in 2009. The collaboration with V. Percec has produced one Science paper (2010, to be accepted after revision). A special kind of collaboration exists with professor Christoph Schalley, Friei Univ. Berlin. Germany, this collaboration involves structural and synthetic chemistry coupled with a research exchange (funded jointly by the Academy of Finland DAAD/Germany in 2006 – 2009) of Ph.D.’s and post doc.’s. A new kind of networking collaboration was funded by Nordforsk/Oslo, Norway and this collaboration involves 11 different group from Nordic and Baltic states: Finland (Rissanen/UJ, Haukka/UEF), Sweden (Öhrström and Håkansson/Gothenburg; Wärnmark and Wendt/Lund), Norway (Görbitz/Oslo), Denmark (McKenzie and Bond/Odense), Lithuania (Butkus/Vilnius) and Estonia (Tamm/Tallinn). The Kolehmainen group has a long term collaboration in bile acid research with prof. Vladimir Král (Inst. Chem. Technol., Prague) in preparing fluorinated steroids, bile acid-porphyrin conjugates and their receptor characteristics, with prof. Jerry Ray Dias in analyzing 13C NMR substituent effects of bile acid derivatives, with prof. Nikolay Lukashev (Moscow State Univ.) in preparing and characterizing macrocyclic bile acid derivatives, with prof. Uday Maitra (Ind. Inst. Sci., Bangalore) in preparing bile acid gapped gold nanoparticles and supramolecular gels. A collaboration with prof. Zdenek Wimmer (Inst. Exp. Bot., Prague) is targeted for preparation of bile acid-juvenoid and bile acid-drug conjugates. Some biological tests are in progress in Univ. Olomouc. Other biological tests are planned to take place with collaboration of prof. Julian Zhu (Univ. Monreal). In addition prof. Anthony P. Davis (Univ. Bristol), prof. Olga Bortolini (Univ. 31 Calabria) and Dr. Milos Budecinsky (Inst. Org. Chem. Biochem, Prague) have acted as referees of the theses of my doctoral students. With prof. Mikiji Miyata (Univ. Osaka) a planned collaboration on solid state NMR and X-ray crystallographic characterization of bile acid-co-crystals and solvates. With prof. Alexander Shavva (Univ. St. Petersburg) we have started a collaboration to prepare steroid gapped gold and magnetic nanoparticles. In tautomerism research of nitrogen heterocycles my group has long term collaboration with prof. Ryszard Gawinecki (Univ. Tech. Life Sci., Bydgoszcz) and prof. Radek Marek (Masaryk Univ., Brno). We have used high-resolution liquid and solid state multinuclear (1H, 13C and 15N) magnetic resonance spectroscopy in characterizing different tautomers and their NMR parameters related with their structural characteristics. These results can be used in planning site specific synthetic routes. Joint with these projects also molecular modeling is frequently used. The Nissinen group collaboration is based on areas where additional expertise or resources are needed or in areas where the group can offer expertise to collaborators. Examples of such are mass spectrometry of supramolecular complexes (Prof. C.A. Schalley, Freie Universität Berlin and Dr. E. Kalenius, UEF) or computational chemistry of supramolecular compounds combined with metal clusters and cations (Prof. H. Häkkinen, JYU). The group has offered expertise in structural and synthetic chemistry to collaborators, especially in Nanoscience Center. Joint thesis and research projects are on-going within NSC. Other important forms of collaboration are educational collaboration and research exchange (Dr. R. Fröhlich, Universität Münster) and industrial collaboration in forms of M.Sc. thesis and Ph.D. thesis (Dr. H. Saxell, BASF SE). The industrial collaboration offers unique prospects to the current development of industrial chemistry and, on the other hand, to the current academic research for industry. For researchers working in the group contacts with collaborators offer possibilities of networking. The most significant outcome of collaboration is realized in forms of joint publications (see Part II. D., Nissinen: no.6, page 30) The Pihko group in extensively engaged with a consortium project “Enabling Synthesis Technologies”, with four academic groups (Pihko / Jyväskylä, Leino / Åbo Akademi, Koskinen / Aalto Univ., Franzén /Tampere Univ. of Tech.) and five companies is one of the largest consortium projects in chemistry, with ca. 1.6 M€ total funding. The project is coordinated by Petri Pihko at Jyväskylä and funded by Tekes as well as the participating companies. The central goals of this project include catalytic methods for asymmetric synthesis of quaternary centers as well as challenging oxidations. Other key collaborative contacts of the Pihko group include ongoing collaboration with Prof. Rik Wierenga (University of Oulu, Department of Biochemistry) on the structure and mechanisms of enolizing enzymes as well as the development of synthetic enolization catalysts and the computational collaboration related to hydrogen bonding catalysis with Prof. Imre Papai (Hungarian Academy of Sciences). G. Societal impact (max. 1 page) Describe the societal impact of the Unit's activities. Describe the Units' public visibility. The unit participates in the development and discussions with the surrounding society whenever possible. The most important forms of participation are industrial (tables 4.8 and 4.10) and educational collaborations, for example in forms of hosting visits of student and interest groups. Professor Pihko has also been active in the field of chemical education, co-authoring a series of textbooks for the use in Finnish high schools (book series “Reaktio”). 32 Jyväskylä has a major societal impact on chemistry education, both at M.Sc. and Ph.D. levels, since the chemical industry of Finland is largely located outside of the Helsinki area and students educated in Jyväskylä tend to have a greater tendency to relocate all around Finland than those trained in the capital region. Some additional contribution to the societal impact via public visibility for the UJ organic chemistry comes from the media coverage (internet, printer press, TV) of some of the Ph.D. thesis and the research results from the unit. e.g. about the 2009 Science papers from the unit. H. Administrative and educational load (max ½ pages) Describe the nature of administrative and educational load. The administrative load has significantly increased during the last few years in forms of internal administrative duties of the University as well as in forms of increased need to get external funding and, on the other hand, changed and more complicated practises in the control of external funding. Increased internal administrative duties apply both for research and education. The education load has remained quite constant but demand for higher quality and quantity of study counseling has required change in attitude but on other hand results in more motivated students and researchers. Recent changes to study program (2008 – 2009) have improved the quality of teaching and the educational load is evenly distributed among teaching staff. I. Funding Assess from your point of view the funding from the following sources: The funding by Academy of Finland in promoting the scientific, educational and societal impact of research (max. 1/2 pages). The unit has been very successful in getting the funding from Academy of Finland (AF) and thus funding plays a crucial role in the unit overall funding. In year 2008 the AF funding was 36.2 % and 2009 37.2 % of the units overall financial resources, being very close to the 40.4% (2008) and 37.1 % (2009) direct budget funding from the University of Jyväskylä. The major part of the AF funding for 2008 and 2009 comes from the academy professorship (Rissanen) and Academy Research Fellow (Sievänen), where both the salary and the research funding of these posts comes solely from the AF. The AF funding plays a key role for the employment of talented post doctoral researchers and Ph.D. students. In research AF funding has played a central role in initiating novel areas of research as well as in ensuring adequate funding for consumables and travelling. In addition it has provided the freedom to concentrate on high-standard curiosity driven basic academic research (such as intermolecular interactions, organocatalysis, total synthesis of complex natural products and supramolecular self-assembly) without having to involve too heavily on commercial applications or company-only funding. The AF funding has been directly or indirectly involved in ca. 30% of all Ph.D. degrees produced by the unit during 2005 – 2009, ca. 60 % based on Graduate School or TEKES funding. Most of the AF funding has ben directed to the post doctoral level. 33 List the researchers that have held an Academy position (Academy Professor, Academy Research Fellow, Postdoctoral Researcher’s Project) Name Kari Rissanen Elina Sievänen Maija Nissinen Elina Sievänen Position Academy Professor Academy Reseach Fellow Academy Reseach Fellow Postdoctoral Researcher’s Project Period 1.1.2008 – 31.12.2012 1.8.2008 – 31.3.2014 1.9.2003 – 31.12.2005 1.8.2004 – 31.7.2007 The funding awarded by other funding organisations in promoting the scientific, educational and societal impacts of research. Assess especially Tekes and EU funding (max. 1 page). For the whole unit the Tekes funding (TF) has been important in the 1990’s and early 2000’s but it has been highly instrumental in the early stage of the Pihko group (still in HUT). The funding from Tekes has become much more difficult since the outsourcing of the R&D in all except pharmaceuticals industry. As the big chemical companies such as Neste Chemicals ceased to exist and larger, still active companies such as Kemira severy diminished their chemistry related R&D rules out in many cases the possibility for Tekes funding. As the true company involvement in the Tekes funded research must be present, this offers possibilities for Tekes funding for only a few chemistry research groups. In UJ only Prof. Pihko’s group is heavily encaged in Tekes funding and has noted some fundamental differences in Tekes and Academy of Finland funding. Based on Pihko’s experiences what matters is whether the research is promising and has potential applications (and also appears attractive to the industry), and although academic credentials are considered, in Pihko’s view, Tekes has been able to promote researchers at an earlier stage of their career compared to the Academy of Finland. In fact, Tekes and chemical industry started to fund Pihko’s research for three years before the Academy of Finland. In addition, Tekes funding allows the academic groups to stay in close contacts with the chemical industry, promoting exchange of ideas, suggesting potential topics for further research, and sprouting industry-sponsored research projects. The unit has been active several times in the 6th and 7th framework programs of EU, but the consortia UJ has been involved with have not been funded bu EU. The funding obtained from industry in promoting the scientific, educational and societal impacts of research (max. 1 page). The units’ participation in industrial collaborative projects has been highly rewarding, resulting in not only refereed scientific publications but also new insights into the actual needs of the society. From the process chemistry standpoint, many topical research areas (e.g. green chemistry) have been overlooked by academic chemists. Very important environmental aspects of industrial chemical processes such as the choices of solvents, catalysts, workup conditions, simpler chemical reactions and the overall safety and efficiency are all issues that are not currently very well addressed by the academia. New ways to improve e.g. large scale synthesis methods, control of polymorph formations, preventation of harmful or dangerous sideproducts, lower production costs, etc., are constanly sought by the chemical industry. 34 J. Future prospects Even though the unit is currently the Finland’s leading unit in chemistry, especially in organic chemistry and supramolecular chemistry, and intends to maintain its position, there are many factors that will affect the future prospects of the unit. The unit has now five active professors (Rissanen, Kolehmainen, Nissinen, Pihko and Paasivirta) and the publication activity and quality is of high international level. As professor Kolehmainen has a plan to retire in 2011 and continue as emeritus the number of active professors will, after some time, decrease to three (Rissanen, Nissinen and Pihko). As Dr. Kolehmainen has been solely responsible of the NMR teaching of the unit, his retirement will cause rearrangements in the NMR teaching. The unit has a plan to recruit a Ph.D. level NMR researcher, whose responsibility would be, in addition to the maintenance of the three existing NMR-equipments, to teach NMR spectroscopy at B.Sc. and M.Sc. levels. This plan is crucial for maintaining the level of NMR education within the unit and the department. The new legal status of the Finnish universities has driven them into financial turmoil. This has had a clear impact on the University of Jyväskylä plans how to maintain and up-date the currently high standard research equipment. The unit needs, as large/expensive research instruments, for its research up-to-date single crystal diffractometers, solution and solid state NMR’s and high-quality mass spectrometers. At present all these instruments are at good level and in active use. However if feasible and robust enough mechanism for the up-date of research infrastructure within University of Jyväskylä is not created, it is very likely thatdecay in the quality of the research infrastructure is evident. If this happens, it will automatically lead to the lowering of the quality of the research and the inevitable loss of high standard international collaborators. At present only the newest mass spectrometer (Applied Biosystems, Qstar Elite) is up-to-date (two years old), the 250 and 500 Mhz NMR’s are 14 years old (the software can no longer be upgraded due to the obsolete electronics) and the two single crystal diffractometers (Bruker-Nonius Kappa APEX-II) are hybrids of two olders instruments and needs to be modernized as soon as possible. On the other hand from 2011 Spring onwards the units three profesors are young (Rissanen will be 51, Nissinen 37 and Pihko 40) when compared to other chemistry units in Finland. Both Nissinen and Pihko have quite young research groups and the full power in research and education of these groups will be rearched in ca. 5 years. The research in UJ organic chemistry has been quite flexible and has been able to adapt to contemporary research topics fast, yet still keeping their core expertise. These new developments include the Rissanens’ recent synthesis work on metal-ion mediated self-assembly of nano-sized cages and spheres (collaboration with M. Fujita, Tokyo and J. Nitschke, Cambridge, UK) and halogen bonding interactions (collaboration with P. Metrangolo, Helsinki/Milan and G. Resnati, Milan), the Kolehmainens’ synthesis work on fluorinated steroids (collaboration with V. Kral, Prague) and gapped gold nanoparticles and supramolecular gels (collaboration with U. Maitra, Bangalore), Nissinen synthesis work on supramolecule protected nanoparticles (collaboration with H. Häkkinen, NSC, Jyväskylä) and Pihkos’ structural chemistry work on the mechanistic studies of iminium catalysis (collaboration with H. Tuononen, UJ, Inorg. Chem. and Rissanen from the same unit). As the ultimate goal of the unit is to create an unique research environment where all the groups will collaborate and share their expertise on common goals by combining molecular design, structural information, supramolecular intermolecular interactions, synthetic chemistry and nanoscince into a truly multidisciplinary consortium of experts focusing on the studies of underlying principles, design, preparation and utilization of new functional supramolecular materials, structure-based design in catalysis (enantioselective catalysis, both organocatalysis and metal catalysis) and biomimetic catalysis. 35