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- W2559920012 abstract "The results of a study devoted to the electronic spectroscopy of gaseous, solid, and cryogenic matrix-isolated methylcyanodiacetylene (CH3C5N) are reported. UV absorption and optical phosphorescence spectra of the compound are described here for the first time, and the corresponding vibronic assignments are proposed. UV absorption, studied directly or through the excitation of phosphorescence, revealed the 1E-- 1A1 system, very weak 1A2– 1A1 bands, and a strong, broad absorption feature, tentatively identified as 1E– 1A1. Spectral measurements were assisted by quantum chemical calculations at the DFT and ab initio (coupled cluster) levels of theory." @default.
- W2559920012 created "2016-12-16" @default.
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- W2559920012 date "2016-12-05" @default.
- W2559920012 modified "2023-09-25" @default.
- W2559920012 title "Electronic Spectroscopy of Methylcyanodiacetylene (CH<sub>3</sub>C<sub>5</sub>N)" @default.
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- W2559920012 doi "https://doi.org/10.1002/cphc.201600949" @default.
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