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首页> 外文期刊>The Journal of Chemical Physics >Rotationally resolved (B)over-tilde-(X)over-tilde electronic spectra of both conformers of the 1-propoxy radical
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Rotationally resolved (B)over-tilde-(X)over-tilde electronic spectra of both conformers of the 1-propoxy radical

机译:1-丙氧基自由基的两个构象异构体的旋转解析(B)叠峰-(X)叠峰电子光谱

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摘要

Five bands of the (B) over tilde-(X) over tilde laser induced fluorescence spectrum of jet-cooled 1-propoxy radical have been recorded with a spectral resolution of approximate to200 MHz. The resolved rotational and fine structure of these bands has been assigned and analyzed providing rotational constants for both the (X) over tilde and (B) over tilde states as well as components of the electron spin-rotation tensor in the (X) over tilde state. By comparison of these constants with ones obtained from quantum chemistry calculations, two bands have been assigned to the gauche (G) conformer of 1-propoxy and 3 bands to the trans (T) conformer. The spectrum of each conformer abruptly terminates after the excitation of a single C-O stretch. (C) 2003 American Institute of Physics. [References: 32]
机译:记录了喷射冷却的1-丙氧基自由基在波浪线上的(B)在波浪线上的(B)-在波浪线上的(X)的五个波段,其光谱分辨率约为200 MHz。已分配并分析了这些带的解析旋转和精细结构,从而提供了在波浪轴上的(X)和在波浪轴上的(B)的旋转常数,以及在波浪线上(X)的电子自旋旋转张量的分量州。通过将这些常数与从量子化学计算中获得的常数进行比较,已将两个谱带分配给1-丙氧基的gauche(G)构象异构体,将3个谱带分配给反式(T)构象异构体。每个构象体的光谱在激发单个C-O片段后突然终止。 (C)2003美国物理研究所。 [参考:32]

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