Supplementary Material (ESI) for Dalton Transactions This journal is © The Royal Society of Chemistry 2001 A. D. Bond and W. Jones Divalent complexes of 3-hydroxy-4-methyl-2(3H)-thiazolethione with Co-Zn: synthesis, X-ray crystal structures and the structure-directing influence of C-H···S interactions Supplementary Information 0 1 0 2 0 3 0 4 0 5 0 2 t h e t a ( d e g r e e s ) Supplementary Figure 1 PXRD profiles of Ni(MTT)2(H2O) 3 measured at room temperature (bottom), 3 measured at 100C (middle), and calculated from the singlecrystal structure of Ni(MTT)2 5. S1 Supplementary Material (ESI) for Dalton Transactions This journal is © The Royal Society of Chemistry 2001 A. D. Bond and W. Jones Divalent complexes of 3-hydroxy-4-methyl-2(3H)-thiazolethione with Co-Zn: synthesis, X-ray crystal structures and the structure-directing influence of C-H···S interactions Supplementary Information 0 1 0 2 0 3 0 4 0 5 0 2 t h e t a ( d e g r e e s ) Supplementary Figure 2 PXRD profiles of Co(MTT)2(H2O) 4 measured at room temperature (bottom), 4 measured at 100C – corresponding to Co(MTT)2 6 – (middle), and calculated from the single-crystal structure of Zn(MTT)2 1. S2 Supplementary Material (ESI) for Dalton Transactions This journal is © The Royal Society of Chemistry 2001 A. D. Bond and W. Jones Divalent complexes of 3-hydroxy-4-methyl-2(3H)-thiazolethione with Co-Zn: synthesis, X-ray crystal structures and the structure-directing influence of C-H···S interactions Supplementary Information Coordination preferences for Ni in complexes with O/S donor ligands Retrieved from the CSD (April 2000 release) 4-coordination S O Ni T4 O S 5-coordination Refcode Coord. geom. Refcode Coord. geom. BEQMIT BINSIA CAQBUR DUPBOF10 FTACNI FUTMIQ JABCEU JOWVIA KEBTIU KODXEG KUDKAV01 sq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. transsq. pl. cissq. pl. cissq. pl. cis- MCOSNI10 MTACNI PEHDAH PEHDEL RIFXIN RIXDAD TACTON VOMZOM WAYVUN ZIZBAL sq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cissq. pl. cis- Refcode Coord. geom. O/S S O Ni NO STRUCTURES T5 O S 6-coordination O/S S O Ni T6 O O/S S Refcode Coord. geom. Refcode Coord. geom. CIJYID DOBZOJ KURLIS NIETCA01 PURVUT QAGCEJ trans- S4O2 fac- S3O3 trans- S4O2 cis- S2O4 cis- S2O4 trans- S2O4 TDACNI ZOJNER cis- S2O4 trans- S2O4 S3 Supplementary Material (ESI) for Dalton Transactions This journal is © The Royal Society of Chemistry 2001 A. D. Bond and W. Jones Divalent complexes of 3-hydroxy-4-methyl-2(3H)-thiazolethione with Co-Zn: synthesis, X-ray crystal structures and the structure-directing influence of CH···S interactions Supplementary Information List of refcodes retrieved from the CSD (April 2000) for the C-H···S interactoins. Where two entries are present for the same structure, only the later entry was used for statistical analyses. 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S36