Effect of hydrogen bonding on the spin density distribution and hyperfine couplings of the p-benzosemiquinone anion radical in alcohol solvents: A hybrid density functional study

Journal of Physical Chemistry A

Volumn 101, Issue 50, 1997, Pages 9813-9817

  O'Malley, Patrick J ^a  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPY; ELECTRON ENERGY LEVELS; ETHANOL; HYDROGEN BONDS; KETONES; METHANOL; ORGANIC SOLVENTS;

ANION RADICALS; BENZOSEMIQUINONE; DENSITY FUNCTIONAL THEORY; HYPERFINE COUPLINGS; SPIN DENSITY DISTRIBUTION;

AROMATIC COMPOUNDS;

EID: 0031358686     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp973032q     Document Type: Article

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