DFT prediction of anomalously large blue shift of the C-H stretching frequency in 2-vinyloxypyridine and -quinoline due to the intramolecular C-H···N hydrogen bonding

Journal of Molecular Structure: THEOCHEM

Volumn 940, Issue 1-3, 2010, Pages 56-60

  Afonin, Andrei V ^a   Vashchenko, Alexander V ^a  

^a A E FAVORSKY IRKUTSK INSTITUTE OF CHEMISTRY   (Russian Federation)

Author keywords

Blue shifting hydrogen bond; DFT; IR spectra; Quantum chemical calculations

Indexed keywords

EID: 72049107809     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.10.004     Document Type: Article

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