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Molecular beam rotational spectrum of cyclobutanone-trifluoromethane: nature of weak CH...O=C and CH...F hydrogen bonds
Authors:Ottaviani Paolo  Caminati Walther  Favero L B  Blanco Susana  López Juan C  Alonso José L
Affiliation:Dipartimento di Chimica G. Ciamician dell' Università, Bologna, Italy.
Abstract:
The molecular beam Fourier transform microwave spectrum of cyclobutanone-trifluoromethane has been assigned and measured. The carbon atom of trifluoromethane lies in the plane of the heavy atoms of cyclobutanone. The complex is stabilized by one C-H...O=C and two C-H...F-C weak hydrogen bonds. The C-H...O=C interaction, involving one carbonylic oxygen, is studied for the first time in detail with rotationally resolved spectroscopy. The two C-H...F-C weak hydrogen bonds involve two fluorine atoms of trifluoromethane and two hydrogens of the same methylenic group in the alpha position.
Keywords:free jets  hydrogen bonds  molecular complexes  molecular dynamics  rotational spectroscopy
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