Blue-shifting hydrogen bonds - are they improper or proper?

被引:171
作者
Barnes, AJ [1 ]
机构
[1] Univ Salford, Mat Res Inst, Salford M5 4WT, Lancs, England
关键词
blue-shift; bond length contraction; hydrogen bonding; vibrational spectroscopy;
D O I
10.1016/j.molstruc.2004.02.040
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
In a review published in 2000 Hobza and Havlas coined the expression 'improper, blue-shifting' to distinguish a type of hydrogen bond which displays characteristics opposite to that expected for a conventional X-H...Y hydrogen bond, i.e. the X-H bond length contracts rather than elongates and the X-H stretching mode shifts to higher frequency, often with reduced intensity, rather than shifting to lower frequency with enhanced intensity. In the present paper, the experimental evidence relating to blue-shifting hydrogen bonding, and the theoretical interpretations which have been advanced, are critically reviewed with the aim of answering the question posed in the title. (C) 2004 Elsevier B.V. All rights reserved.
引用
收藏
页码:3 / 9
页数:7
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