In WebMO build a model of 1,2-dichloro-1-fluoroethane. Conduct a dihedral angle coordinate scan by initially setting the
Posted: Sun May 22, 2022 5:23 pm
3. Login to WebMO and build a model of 1,3-hexadiene (shown below). 2 6 1 3 5 1,3-hexadiene Be sure and use "comprehensive" or "comprehensive mechanics" clean-up to adjust the bond lengths to within appropriate distances prior to conducting a geometry optimization. Once the molecule is constructed, conduct a geometry optimization using the AM1 theory level. View the completed job and inspect the carbon-carbon single bond lengths (C2 to C3, C4 to CS, and C5 to C6). Be sure to draw the molecule and indicate the bond lengths as part of your work to turn in.