CH⋯O interaction lowers hydrogen transfer barrier to keto-enol tautomerization of β-cyclohexanedione: Combined infrared spectroscopic and electronic structure calculation study

Journal of Physical Chemistry A

Volumn 116, Issue 15, 2012, Pages 3836-3845

  Bandyopadhyay, Biman ^a   Pandey, Prasenjit ^a   Banerjee, Pujarini ^a   Samanta, Amit K ^a   Chakraborty, Tapas ^a  

^a DEPARTMENT OF MATERIALS SCIENCE   (India)

Author keywords

[No Author keywords available]

Indexed keywords

ARGON MATRICES; DIMERIC COMPLEXES; ELECTRONIC STRUCTURE CALCULATIONS; HIGH TEMPERATURE; HYDROGEN TRANSFER; HYDROGEN-BONDED DIMERS; INFRARED SPECTROSCOPIC; INFRARED SPECTRUM; INTERMOLECULAR MODES; IR SPECTRUM; MOLECULAR ASSOCIATIONS; TAUTOMERIC FORMS; TAUTOMERIZATIONS; TEMPERATURE RANGE; THIN SOLID FILM; TRANSITION STATE;

CHEMICAL BONDS; DIMERS; ELECTRONIC STRUCTURE; HYDROGEN; MOLECULES;

VAPORS;

EID: 84860147803     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp2108736     Document Type: Article

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