A plausible mechanism for copper-catalyzed oxidative chlorophenol coupling reactions. Semi-empirical AM1 and ab initio 3-21G molecular orbital studies

Chemosphere

Volumn 38, Issue 8, 1999, Pages 1825-1832

  Tuppurainen, Kari ^a   Ruuskanen, Juhani ^a  

^a UNIVERSITY OF EASTERN FINLAND   (Finland)

Author keywords

Ab initio calculations; AM1; Chlorophenols; Mechanism; Oxidative coupling; PCDDs; PCDFs

Indexed keywords

CHLOROPHENOL; COPPER; POLYCHLORINATED DIBENZODIOXIN; POLYCHLORINATED DIBENZOFURAN;

AIR POLLUTION; ARTICLE; CALCULATION; FLY ASH; OXIDATION;

EID: 0033120035     PISSN: 00456535     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0045-6535(98)00397-X     Document Type: Article

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