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三元环的振动泛音光谱学

Vibrational overtone spectroscopy of three-membered rings.

作者信息

Hsieh Shizuka, Miller Benjamin J, Södergren A Helena, Kjaergaard Henrik G

机构信息

Chemistry Department, Smith College, Clark Science Center, Northampton, MA 01063, USA.

出版信息

J Phys Chem A. 2007 Jun 28;111(25):5415-21. doi: 10.1021/jp070636d. Epub 2007 Jun 1.

Abstract

We have recorded vapor-phase photoacoustic spectra of cyclopropane, ethylene oxide, and ethylene sulfide in the third, fourth, and fifth CH-stretching overtone regions. We have used a harmonically coupled anharmonic oscillator local mode model to facilitate analysis of the spectra. Fermi resonance between the CH-stretching and HCH-bending vibrations is essential to explain the observed wide and multistructured CH-stretching overtone bands. A number of weak combination bands can account for the remaining experimental features observed to the blue of the CH-stretching regions. We have reassigned the fundamental spectra of these three-membered rings.

摘要

我们记录了环丙烷、环氧乙烷和乙硫醚在第三、第四和第五个CH伸缩泛频区域的气相光声光谱。我们使用了一种谐波耦合非谐振荡器局域模式模型来促进光谱分析。CH伸缩振动和HCH弯曲振动之间的费米共振对于解释观察到的宽且多结构的CH伸缩泛频带至关重要。一些弱组合带可以解释在CH伸缩区域蓝色一侧观察到的其余实验特征。我们重新归属了这些三元环的基频光谱。

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