✦ LIBER ✦

Graph theory and molecular orbitals. Total φ-electron energy of alternant hydrocarbons

✍ Scribed by I. Gutman; N. Trinajstić

Publisher: Elsevier Science
Year: 1972
Tongue: English
Weight: 284 KB
Volume: 17
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(72)85099-1

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✦ Synopsis

The dependence of the Hiickal total n-electron energy on the molecular topology is shown. ckneid ruks governing the structural dependence of the n-electron energy in conjugated molecules are derived.

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