Unexpected "amphoteric" character of the halogen bond: the charge density study of the co-crystal of N-methylpyrazine iodide with I2

被引：70

作者：

Nelyubina, Yulia V. ^{[1
]}

Antipin, Mikhail Yu. ^{[1
]}

Dunin, Dmitriy S. ^{[2
]}

Kotov, Vitalii Yu. ^{[2
]}

Lyssenko, Konstantin A. ^{[1
]}

机构：

[1] Russian Acad Sci, AN Nesmeyanov Inst Organoelement Cpds, Moscow 119991, Russia

[2] Moscow City Pedag Univ, Dept Biol & Chem, Moscow 105568, Russia

来源：

CHEMICAL COMMUNICATIONS | 2010年 / 46卷 / 29期

基金：

俄罗斯基础研究基金会;

关键词：

COMPLEXES; MOLECULES; AIM;

D O I：

10.1039/c0cc01094d

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

An unexpected mechanism of halogen bonding that cannot be rationalized within the accepted sigma-hole model was found in the co-crystal of N-methylpyrazine iodide with molecular iodine via the topological analysis of the electron density distribution derived from the high-resolution X-ray diffraction data.

引用

页码：5325 / 5327

页数：3

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