Nonbonded P•••P and P•••Se interactions in naphthalene 1,8-positions:: Role of lone-pair orbitals

被引：25

作者：

Nakanishi, W ^{[1
]}

Hayashi, S ^{[1
]}

机构：

[1] Wakayama Univ, Fac Sys Engn, Dept Chem, Wakayama 6408510, Japan

来源：

PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS | 2002年 / 177卷 / 6-7期

关键词：

ab initio MO calculations; lone pair; naphthalene 1,8-positions; nonbonded interactions; phosphorus; selenium;

D O I：

10.1080/10426500212208

中图分类号：

O61 [无机化学];

学科分类号：

070301 ; 081704 ;

摘要：

The lone pair-lone pair repulsion plays an important role in the non-bonded P...P interaction in naphthalene 1,8-positions. The conformations around P and Se in 8-(PhSe)-1-(Ph2P=O)C10H6 are determined by the attractive O...Se-C 3c-4e type interaction. The P...Se interaction in the 1,8-positions is also discussed.

引用

收藏

页码：1833 / 1837

页数：5

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