A model study of the interaction of a hydrogen bond with a π-electron system |
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| Authors: | John R Sabin |
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| Institution: | (1) Quantum Theory Project, Department of Physics and Astronomy, University of Florida, 32601 Gainesville, Florida, USA |
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| Abstract: | A semi-empirical CNDO/2 calculation of the structure of the diimide-hydrogen fluoride hydrogen bonded complex is reported. The results are compared to calculations on a similar saturated system in an attempt to elucidate the effect of a neighboring  -system on a hydrogen bond, and to uncomplexed diimide to study the effect of the hydrogen bond on the -system. |
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