A theoretical DFT study on the structural parameters and intramolecular hydrogen-bond strength in substituted (Z)-N-(thionitrosomethylene)- thiohydroxylamine systems

Bulletin of the Chemical Society of Japan

Volumn 86, Issue 11, 2013, Pages 1261-1271

  Raissi, Heidar ^a   Khanmohammadi, Azadeh ^b   Mollania, Fariba ^a  

^a UNIVERSITY OF BIRJAND   (Iran)

^b PAYAME NOOR UNIVERSITY   (Iran)

Author keywords

[No Author keywords available]

Indexed keywords

BOND CRITICAL POINTS; EFFECT OF SUBSTITUTION; HARMONIC OSCILLATOR MODEL OF AROMATICITY; HYDROGEN BONDING INTERACTIONS; MOLECULAR ELECTRON DENSITY TOPOGRAPHY; NATURAL POPULATION ANALYSIS; NUCLEUS INDEPENDENT CHEMICAL SHIFTS; TOPOLOGICAL PROPERTIES;

CARRIER CONCENTRATION; CHEMICAL SHIFT; CHLORINE; CHLORINE COMPOUNDS; ELECTRON DENSITY MEASUREMENT; ELECTRONS; FLUORINE; HYDROGEN; HYDROGEN BONDS; OSCILLATORS (MECHANICAL); POPULATION STATISTICS; TOPOLOGY;

DENSITY FUNCTIONAL THEORY;

EID: 84888869847     PISSN: 00092673     EISSN: 13480634     Source Type: Journal    
DOI: 10.1246/bcsj.20120242     Document Type: Article

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