Soviet Physics Journal

, Volume 10, Issue 4, pp 60–62 | Cite as

Atomic interaction in molecules

Part I. MO LCAO Calculations on electron density for p-Mono- and pp'-disubstituted diphenylamines
  • L. I. Lagutskaya
  • N. A. Prilezhaeva
Article
  • 11 Downloads

Abstract

The simple MO LCAO method is used, with donor substituants characterized by a parametric relation. The electron-density distribution in the phenyl rings in the ground state is governed only by groups directly connected to the rings. Excitation produces density transfer along the molecule from a donor group in one ring to an acceptor in the other.

Keywords

Phenyl Phenyl Ring Parametric Relation Donor Group Atomic Interaction 

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Copyright information

© The Faraday Press, Inc. 1971

Authors and Affiliations

  • L. I. Lagutskaya
    • 1
  • N. A. Prilezhaeva
    • 1
  1. 1.Kuznetsov Siberian Physico-technicalInstituteUSSR

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