Strong intramolecular hydrogen bonds. Part I. Vibrational frequencies of the OH group in some picolinic acid N-oxides predicted from DFT calculated potentials and located in the infrared spectra

Journal of Molecular Structure: THEOCHEM

Volumn 500, Issue 1-3, 2000, Pages 429-440

  Stare, J ^a   Mavri, J ^a   Ambrozic G ^a   Hadzi D ^a  

^a NATIONAL INSTITUTE OF CHEMISTRY   (Slovenia)

Author keywords

DFT calculations; Hydrogen bonding; Infrared spectra; Potential functions

Indexed keywords

ACETONITRILE; CHLOROFORM; OXIDE; QUINALDIC ACID;

ARTICLE; HYDROGEN BOND; INFRARED SPECTROMETRY; MATHEMATICAL COMPUTING; ORGANIC CHEMISTRY; PREDICTION; THEORY; VIBRATION;

EID: 0034599642     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0166-1280(00)00380-8     Document Type: Article

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