A Hybrid Density Functional Study of O-O Bond Cleavage and Phenyl Ring Hydroxylation for a Biomimetic Non-Heme Iron Complex

Inorganic Chemistry

Volumn 43, Issue 10, 2004, Pages 3277-3291

  Borowski, Tomasz ^a   Bassan, Arianna ^a   Siegbahn, Per E M ^a  

^a STOCKHOLM UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

2 OXOGLUTARIC ACID; BIOMIMETIC MATERIAL; BORIC ACID; FORMIC ACID DERIVATIVE; HYDROGEN PEROXIDE; IRON COMPLEX; LIGAND; OXOACID; OXYGENASE; PHENOL; PHENYL GROUP; PYRAZOLE DERIVATIVE; RADICAL;

ARTICLE; CHEMICAL BOND; COMPARATIVE STUDY; COMPLEX FORMATION; DECARBOXYLATION; DENSITY FUNCTIONAL THEORY; ELECTRON TRANSPORT; ENERGY; ENTHALPY; ENTROPY; ENZYME ACTIVITY; HYDROXYLATION; OXIDATION; REACTION ANALYSIS; SURFACE PROPERTY; SYNTHESIS;

BIOMIMETIC MATERIALS; DECARBOXYLATION; ELECTRON TRANSPORT; FREE RADICALS; IRON; KETO ACIDS; KETOGLUTARIC ACIDS; KINETICS; LIGANDS; NONHEME IRON PROTEINS; ORGANOMETALLIC COMPOUNDS; OXYGEN; OXYGENASES; PHENOLS; SUPEROXIDES; THERMODYNAMICS;

EID: 2442605525     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic035395c     Document Type: Article

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