Allylic oxidation of cyclohexene catalyzed by manganese porphyrins: DFT studies

Catalysis Today

Volumn 169, Issue 1, 2011, Pages 10-15

  Rutkowska Zbik, D ^a   Witko, M ^a   Serwicka, E M ^a  

^a INSTITUTE OF CATALYSIS AND SURFACE CHEMISTRY   (Poland)

Author keywords

Allylic oxidation; Density functional calculations; Epoxidation; Homogeneous catalysis; Manganese porphyrin

Indexed keywords

ACTIVE SITE; ALLYLIC OXIDATION; C-H BOND; CATALYST MOLECULE; CYCLOHEXENES; DENSITY-FUNCTIONAL CALCULATIONS; DFT STUDY; HOMOGENEOUS CATALYSIS; HYDROGEN ATOMS; INTERMEDIATE STRUCTURES; MANGANESE PORPHYRIN; MANGANESE PORPHYRINS; OH GROUP; RADICAL DISSOCIATIONS; REACTION PATHWAYS; SPIN CROSSINGS;

CATALYSIS; CATALYST ACTIVITY; DENSITY FUNCTIONAL THEORY; MANGANESE; OXIDATION; PHYSISORPTION; PORPHYRINS; REACTION INTERMEDIATES; REACTION KINETICS;

OLEFINS;

EID: 79958095513     PISSN: 09205861     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cattod.2010.09.014     Document Type: Article

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