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首页> 外文期刊>Chemical Physics Letters >Infrared absorption spectra of ethynyl radicals isolated in solid Ne: Identification of the fundamental C-H stretching mode
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Infrared absorption spectra of ethynyl radicals isolated in solid Ne: Identification of the fundamental C-H stretching mode

机译:固体Ne中分离的乙炔基的红外吸收光谱:基本C-H拉伸模式的鉴定

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摘要

Irradiation of a sample near 3.0 K of ethyne, C2H2, in a Ne matrix with vacuum ultraviolet radiation from a synchrotron produced various photoproducts that were analyzed through their infrared absorption spectra. Photolysis with light at 171 nm yielded as major product ethynyl radical, C2H. Based on observed D-isotopic shifts and comparison of observed vibrational wavenumbers and isotopic ratios with values predicted with quantum- chemical calculations, we identified the nu(1) and nu(3) modes of C2H to be 3293.3 and 1835.7 cm(1), respectively. The fundamental C-H stretching nu(1) mode of C2H was determined for the first time in solid Ne.
机译:用同步加速器产生的真空紫外辐射在Ne矩阵中的3.0 K附近的乙炔C2H2样品中照射真空,产生了各种光产物,并通过其红外吸收光谱对其进行了分析。用171 nm的光进行光解可得到主要产物乙炔基C2H。根据观测到的D同位素位移以及观测到的振动波数和同位素比与通过量子化学计算预测的值的比较,我们确定C2H的nu(1)和nu(3)模式为3293.3和1835.7 cm(1),分别。首次在固体Ne中确定了C2H的基本C-H拉伸nu(1)模式。

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