Influence of the geometry of a hydrogen bond on conformational stability : a theoretical and experimental study of ethyl carbamate

Spectra of ethyl carbamate (urethane) in the gas phase have been recorded in the microwave (4-20 GHz), millimeter-wave (49-118 GHz and 150-235 GHz) and mid-infrared (1000-1900 cm(-1)) regions. At the same time, high level ab initio calculations have been performed in order to both predict the experi...

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Veröffentlicht in:Physical chemistry chemical physics : PCCP 2009-01, Vol.11 (11), p.1719-1728
Hauptverfasser: GOUBET, M, MOTIYENKO, R. A, REAL, F, MARGULES, L, HUET, T. R, ASSELIN, P, SOULARD, P, KRASNICKI, A, KISIEL, Z, ALEKSEEV, E. A
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Sprache:eng
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