Molecular orbital electronegativity |
| |
| Authors: | MC Böhm KD Sen PC Schmidt |
| |
| Institution: | Institut fr? Organische Chemie, D-6900 Heidelberg, West Germany;Institut für Physikalische Chemie, Technische Hochschule Darmstadt, D-6100 Darmstadt, West Germany |
| |
| Abstract: | The molecular orbital electronegativities of a representative set of free radicals of Be, BC, N and O have been calculated for the first time using the transition operator method within the semi-empirical CNDO LCAO MO theory. The significance of the effect of delocalization on electronegativity is discussed. |
| |
| Keywords: | |
| 本文献已被 ScienceDirect 等数据库收录！ |
|
