GIAO/DFT calculated chemical shifts of tautomeric species. 2-Phenacylpyridines and (Z)-2-(2-hydroxy-2-phenylvinyl) pyridines

Magnetic Resonance in Chemistry

Volumn 39, Issue 6, 2001, Pages 334-340

  Ośmiałowski, Borys ^a   Kolehmainen, Erkki ^b   Gawinecki, Ryszard ^a  

^a UNIVERSITY OF TECHNOLOGY AND LIFE SCIENCES   (Poland)

^b UNIVERSITY OF JYVÄSKYLÄ   (Finland)

Author keywords

2 phenacylpyridine; 13C NMR; 15N NMR; Ab initio HF; Enolimine; GIAO DFT; Intramolecular hydrogen bonding; Ketimine; NMR

Indexed keywords

CHEMICAL SHIFT; GEOMETRY; HYDROGEN; HYDROGEN BONDS; X RAY CRYSTALLOGRAPHY;

13C NMR; 15N NMR; 2-PHENACYLPYRIDINE; AB INITIO/HF; BASIS SETS; ENOLIMINE; GIAO DFT; INTRAMOLECULAR HYDROGEN BONDING; KETIMINES; NMR CHEMICAL SHIFTS;

PYRIDINE;

EID: 0037893958     PISSN: 07491581     EISSN: None     Source Type: Journal    
DOI: 10.1002/mrc.856     Document Type: Article

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