X-H•••Y (X, Y = N, O) hydrogen bonds:: A new bond valence sum analysis

被引：6

作者：

Banerjee, Kamalika ^{[1
]}

De, Senjuti ^{[1
]}

Datta, Dipankar ^{[1
]}

机构：

[1] Indian Assoc Cultivat Sci, Dept Inorgan Chem, Kolkata 700032, W Bengal, India

来源：

JOURNAL OF CHEMICAL CRYSTALLOGRAPHY | 2007年 / 37卷 / 10期

关键词：

hydrogen bonding; bond valence; BVS;

D O I：

10.1007/s10870-007-9230-9

中图分类号：

O7 [晶体学];

学科分类号：

0702 ; 070205 ; 0703 ; 080501 ;

摘要：

For X-H center dot center dot center dot Y hydrogen bonds, a plot of 1/r (X-H) versus 1/r (H center dot center dot center dot Y) is found to be reasonably linear with a negative slope of magnitude less than unity. These observations are explained by using Datta's bond valence sum model (Naskar JP, Hati S Datta D, Acta Crystallogr B 53, 885, 1997). It is revealed that the donor atom plays a more significant role in X-H center dot center dot center dot Y.

引用

页码：675 / 677

页数：3

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