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


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.


Phenyl Phenyl Ring Parametric Relation Donor Group Atomic Interaction 
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  1. 1.
    A. Mangini and R. Passerini, J. Chem. Soc., 1168, 1952.Google Scholar
  2. 2.
    A. Mangini and R. Passerini, J. Chem. Soc., 4954, 1956.Google Scholar
  3. 3.
    A. Mangini and R. Passerini, Experienta,12, 49, 1956.Google Scholar
  4. 4.
    H. H. Szmant and J. J. McIntosh, J. Am. Chem. Soc.,73, 4356, 1956.Google Scholar
  5. 5.
    V. A. Izmail'skii and A. M. Simonov, ZhOKh,16, 1659, 1946.Google Scholar
  6. 6.
    V. A. Izmail'skii and K. A. Nuridzanyan, DAN SSSR,129, 1053, 1959.Google Scholar
  7. 7.
    G. Modena, Boll. sci. Fac. chim. industria (Bologna),17, 45, 1959.Google Scholar
  8. 8.
    G. Modena, Advances in Mol. Spectroscopy,2, no. 2, 483, 1962.Google Scholar
  9. 9.
    L. I. Lagutskaya and V. I. Danilova, Zh. Strukt. Khim.,6, 397, 1965.Google Scholar
  10. 10.
    T. E. Peacock, Proc. Phys. Soc.,78, 460, 1961.Google Scholar
  11. 11.
    K. M. Moser, J. Chem. Soc., 1072, 1953.Google Scholar
  12. 12.
    G. Rasch, Z. f. Chemie.,2, 347, 1962.Google Scholar
  13. 13.
    S. Abrahams, Usp. Khimii,27, 107, 1958.Google Scholar
  14. 14.
    A. W. Hanson, Acta crystal.,6, 32, 1953.Google Scholar
  15. 15.
    R. Rahradnik, C. Parkanyi, V. Horak, and J. Koutecky, Collection:28, 776, 1963.Google Scholar
  16. 16.
    K. Bocec, A. Mangini, and R. Zahradnik, J. Chem. Soc., 225, 1963.Google Scholar
  17. 17.
    P. P. Shorygin and Z. B. Egorova, ZhOKh,33, 1477, 1959; DAN SSSR, 118, 763, 1958.Google Scholar
  18. 18.
    Yu. L. Frolov, Dissertation, Irkutsk, 1965.Google Scholar

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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