Effect of OH internal torsion on the OH-stretching spectrum of cis,cis-HOONO

被引：9

作者：

Schofield, DP ^{[1
]}

Kjaergaard, HG ^{[1
]}

机构：

[1] Univ Otago, Dept Chem, Dunedin, New Zealand

来源：

JOURNAL OF PHYSICAL CHEMISTRY A | 2005年 / 109卷 / 09期

关键词：

D O I：

10.1021/jp0448999

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：

We show that a simple two-dimensional vibrational model can explain most of the features observed in the first and second OH-stretching overtone region of the room temperature cis,cis-HOONO spectrum. The model uses ab initio calculated parameters and includes the OH-stretching mode coupled to the internal torsion of the OH group.

引用

页码：1810 / 1814

页数：5

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