Prediction of reactive sites for the electropolymerization of p-benzenesulfonic acid derivatives: Ab initio and experimental study

International Journal of Quantum Chemistry

Volumn 99, Issue 1, 2004, Pages 11-27

  Nabais, Catarina ^a   Fartaria, Rui P S ^a   Fernandes, Fernando M S Silva ^a   Abrantes, Luísa M ^a  

^a UNIVERSITY OF LISBON   (Portugal)

Author keywords

Ab initio methods; Electrooxidation mechanism; Electropolymerization; p benzenesulfonic acid; Unpaired electron spin density

Indexed keywords

BENZENE; DERIVATIVES; ELECTROLYSIS; ELECTRONIC STRUCTURE; ELECTRONS; ELECTROPOLYMERIZATION; MASS SPECTROMETRY; OXIDATION; PARAMAGNETIC RESONANCE; PHOTOIONIZATION; REACTION KINETICS;

AB INITIO METHODS; ELECTROOXIDATION MECHANISM; P-BENZENESULFONIC ACID; UNPAIRED ELECTRON SPIN DENSITY;

AROMATIC COMPOUNDS;

EID: 3042596602     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.20099     Document Type: Article

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