Infrared spectroscopy of isoprene in noble gas matrices

Journal of Molecular Spectroscopy(2018)

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摘要
•The first measurement of well-resolved vibrational bands of isoprene by matrix-isolation.•Anharmonic DFT vibrational calculations leading to the unambiguous assignments of fundamental bands.•Alternative assignments to the weak bands in the 900–1100cm−1 ​region.
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关键词
Isoprene,Matrix isolation,Infrared spectroscopy,Density functional theory,Anharmonic vibrational calculation
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