Intramolecular hydrogen-bonding interactions in 2-nitrosophenol and nitrosonaphthols: Ab initio, density functional, and nuclear magnetic resonance theoretical study

Journal of Physical Chemistry A

Volumn 111, Issue 30, 2007, Pages 7112-7123

  Shchavlev, Andrew E ^a   Pankratov, Alexei N ^b   Enchev, Venelin ^c  

^a VOLGA REGION STATE UNIVERSITY OF SERVICE   (Russian Federation)

^b SARATOV STATE UNIVERSITY   (Russian Federation)

^c INSTITUTE OF ORGANIC CHEMISTRY   (Bulgaria)

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY FUNCTIONAL THEORY; HYDROGEN BONDS; MOLECULAR STRUCTURE; NUCLEAR MAGNETIC RESONANCE; OPTIMIZATION;

GEOMETRY OPTIMIZATION; INTRAMOLECULAR HYDROGEN-BONDING INTERACTIONS; NITROSONAPHTHOLS; QUINONE-MONOOXIME TAUTOMERS;

ALCOHOLS;

EID: 34548290855     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp068540r     Document Type: Article

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