A molecular orbital study on the electron donating and accepting abilities of non-alternant polycyclic conjugated hydrocarbons

Yuriko Aoki, Akira Imamura, Ichiro Murata

Research output: Contribution to journalArticle

8 Citations (Scopus)

Abstract

Electronic properties of non-alternant polycyclic conjugated hydrocarbons are investigated by using the perturbation theory for degenerate systems on the basis of NBMOs of alternants. The HOMO and the LUMO energy levels are represented as a function of the size of the odd membered-ring included in the non-alternant polycyclic hydrocarbon.

Original languageEnglish
Pages (from-to)6659-6672
Number of pages14
JournalTetrahedron
Volume46
Issue number19
DOIs
Publication statusPublished - Jan 1 1990
Externally publishedYes

All Science Journal Classification (ASJC) codes

  • Biochemistry
  • Drug Discovery
  • Organic Chemistry

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