Drawing Molecules in ChemSketch This exercise is to show you how to use ChemSketch to draw molecules, and to look at the molecules in the 3D viewer. Drawing METHANE Open ChemSketch, make sure you are in structure mode Click on the C (for Carbon) in the left hand column, then Click somewhere in the blank workspace. You will see CH4 appear in the workspace. ChemSketch automatically adds the hydrogens to carbons, but you can change this if you need to. To make it look like a molecule Click on the H (for Hydrogen in the left hand column) Click on the C in the workspace, and drag away from the C about one centimeter to draw the hydrogen bond. Repeat for the other 3 hydrogen bonds Select the methane molecule by clicking on the selection button. Then click on the square selection button (The other option is a lasso selection can be used for irregular shapes) , which Then drag the mouse over the molecule Selection handles should appear, as in the picture. Now the molecule is selected, you need to get it Ready to view in the 3D viewer. ©2011 University of Illinois Board of Trustees • http://islcs.ncsa.illinois.edu/copyright Click on the 3D optimization button at the far right end of that row of buttons A pop-up will appear asking to remove hydrogens. Click No. The molecule on the screen should now look like this, If you click the mouse on the page, the selection marks will disappear, and you can see that the molecule looks a bit 3D already, but not very exciting. To see the molecule in the 3D viewer, click on the button above the 3D optimization button. The screen will now switch to the 3D window, which by default has a black background. The model usually appears as a stick model, but you can change this to a different kind of model, eg ball and stick or space fill, using the buttons. Stick Model Ball and Stick The models can be rotated, with the mouse, so you can look at them from any angle. To measure the distance between 2 atoms, click . . Then click the mouse on the first atom, then on the second. The distance between the 2 atoms will be shown on the status bar at the bottom ©2011 University of Illinois Board of Trustees • http://islcs.ncsa.illinois.edu/copyright To measure bond angles, click ,then on the 3 atoms with the angle atom in the middle, and the angle between them is shown on the status bar at the bottom What are the bond angles in methane? Save the molecule, the molecule will be saved as a 3D file. Close the 3D window by clicking in the top right hand cross. This will take you back to the normal ChemSketch window. You can also switch between 3D and ChemSketch using the tabs at the bottom left of the screen. If you want to save the drawing of the methane molecule, you will need to save it again from the Chemsketch window, it will save as a file with an .SK2 extension. Close the methane file (File-Close). Now try following exactly the same procedure, and draw a molecule of Ammonia. Instead of starting with C as the first atom, start with N, and add 3 Hydrogens. What are the bond angles in Ammonia? Draw and measure the bond angles in SO2, H2O and CCl4, filling in the worksheet as you go along. ©2011 University of Illinois Board of Trustees • http://islcs.ncsa.illinois.edu/copyright Shapes of Molecules Worksheet Using the attached guide, learn how to draw structures in ChemSketch and view them in 3D. Draw and look at each of the molecules below using ChemSketch. Copy to the 3D viewer. For each one measure the bond angles, draw the shape on the worksheet, and decide the geometry of the molecule. The first one is done for you. Molecule Drawing Methane CH4 Bond Angles All 109.5 H 0 Shape of Molecule Tetrahedral o 109.5 C H H H Ammonia NH3 Sulfur Dioxide SO2 Carbon Tetrachloride CCl4 Your choice http://excellence.qia.org.uk/page.aspx?o=140401 original document source ©2011 University of Illinois Board of Trustees • http://islcs.ncsa.illinois.edu/copyright