MOLECULAR ORBITAL INCREASED VALENCE VALENCE BOND AND NON-PAIRING SPATIAL ORBITAL FORMULAE FOR 3-CENTRE BONDING

被引：40

作者：

HARCOURT, RD

机构：

[1] Department of Chemistry, University of Melbourne, Parkville, VIC

来源：

AUSTRALIAN JOURNAL OF CHEMISTRY | 1969年 / 22卷 / 02期

关键词：

D O I：

10.1071/CH9690279

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The simple valence-bond and molecular orbital formulae for three-centre bonding involving four electrons and three atoms Y, A, and B are Ÿ A⎯B ⟷ Y⎯A 'P, and Y---A---B Increased-valence formulae that have been developed recently are Y⎯A. Ḃ and Ẏ. A⎯B If Y and B are the same type of atom, and bond-orbitals are used as wave functions for Y⎯A and A⎯B bonds, then the near-equivalence of the molecular orbital and increased-valence wave functions is demonstrated. Bond-orders (or numbers) for these and Linnett's5s6 non-pairing spatial orbital formula Ẏ. A. B are calculated. © 1969, CSIRO. All rights reserved.

引用

页码：279 / &

共 20 条

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