C-H oxidation by hydroxo manganese(v) porphyrins: a DFT study.
A DFT study on toluene oxidation by Mn(V) porphyrins shows that both MnV(O) and, remarkably, MnV(OH) are potent H-atom abstractors.
Balcells
David
D
Université Montpellier 2, Institut Charles Gerhardt, CNRS 5253, cc-1501 Place Eugène Bataillon, 34095, Montpellier, France.
Raynaud
Christophe
C
Crabtree
Robert H
RH
Eisenstein
Odile
O
D002244:Carbon / Q000737:chemistry*; D006859:Hydrogen / Q000737:chemistry*; D010084:Oxidation-Reduction; D011166:Porphyrins / Q000737:chemistry*
D011166:Porphyrins; D002244:Carbon; D006859:Hydrogen