In Webmo Build A Model Of 1 2 Dichloro 1 Fluoroethane Conduct A Dihedral Angle Coordinate Scan By Initially Setting The 1 (18.03 KiB) Viewed 16 times
In Webmo Build A Model Of 1 2 Dichloro 1 Fluoroethane Conduct A Dihedral Angle Coordinate Scan By Initially Setting The 2 (30.29 KiB) Viewed 16 times
In WebMO build a model of 1,2-dichloro-1-fluoroethane. Conduct a dihedral angle coordinate scan by initially setting the Cl-C-C-Cl bond to 0°. Scan from 0.01° through 360° using the AMI theory level. Consult exercise #1 for more details about the calculation. At what dihedral angle is the minimum energy found? Explain why the angle is not exactly 180º.
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.
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