Semi-empirical studies of molecular vibrations:: Part 2 A study of the vibrations of the benzene and perdeutero benzene molecules |
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| Authors: | JT Gleghorn S Hadjipavlou FW McConkey |
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| Institution: | University of Lancaster, Department of Chemistry, Bailrigg, LancasterGreat Britain |
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| Abstract: | The MINDO/2 prime method is applied to the study of the force field of the benzene molecule. Force constants are recorded and compared with the data of Duinker and Mills. The wavenumbers of vibration are calculated for both perhydro and perdeuterobenzene, and the values compared with experiment. |
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