Bifunctional influence of 3-chloro substitution on structural and energetic characteristics of N-methyl-salicylidene imines

Journal of Molecular Structure

Volumn 976, Issue 1-3, 2010, Pages 19-29

  Koll, A ^a   Janski, J ^a   Karpfen, A ^b   Wolschann, P ^b  

^a UNIVERSITY OF WROC AW   (Poland)

^b UNIVERSITY OF VIENNA   (Austria)

Author keywords

DFT calculations; Energy of hydrogen bond; Intramolecular hydrogen bonds; Steric effects; Structure of hydrogen bond

Indexed keywords

DFT CALCULATION; DFT CALCULATIONS; ENERGY OF HYDROGEN BOND; INTRAMOLECULAR HYDROGEN BOND; STERIC EFFECT;

CHARGE TRANSFER; FUNCTIONAL GROUPS; HYDROGEN; NITROGEN COMPOUNDS; ORGANIC POLYMERS; QUANTUM CHEMISTRY; THERMODYNAMIC PROPERTIES;

HYDROGEN BONDS;

EID: 77953694902     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2009.12.028     Document Type: Article

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