Anisotropic and hydrogen bonding effects in phenylglyoxamides and mandelamides: Theoretical and NMR conformational evaluation

Magnetic Resonance in Chemistry

Volumn 46, Issue 5, 2008, Pages 418-426

  Gonçalves, Blank T ^a   Esteves, Pierre M ^a   Pinto, Angelo C ^a   Kaiser, Carlos R ^a   Da Silva, Fernanda L ^a   Miguez, Eduardo ^a   Da Silva, Joaquim F M ^a  

^a FEDERAL UNIVERSITY OF RIO DE JANEIRO   (Brazil)

Author keywords

13C; 1H; Anisotropic effects; DFT calculations; Hydrogen bonding; Mandelamides; NMR; Phenylglyoxamides; PM3 calculations

Indexed keywords

ANISOTROPY; CONFORMATIONS;

13C; 1H; ANISOTROPIC EFFECTS; B3LYP/6-31G CALCULATIONS; DFT CALCULATION; GOOD CORRELATIONS; HYDROGEN-BONDING EFFECTS; MANDELAMIDE; PHENYLGLYOXAMIDE; PM3 CALCULATION;

HYDROGEN BONDS;

GLYOXAMIDE; HYDROGEN; MANDELAMIDE; MANDELIC ACID DERIVATIVE; SULFONYLUREA DERIVATIVE;

ANISOTROPY; ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; HYDROGEN BOND; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

ANISOTROPY; COMPUTER SIMULATION; HYDROGEN; HYDROGEN BONDING; MAGNETIC RESONANCE SPECTROSCOPY; MANDELIC ACIDS; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; SULFONYLUREA COMPOUNDS;

EID: 43749084155     PISSN: 07491581     EISSN: 1097458X     Source Type: Journal    
DOI: 10.1002/mrc.2192     Document Type: Article

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