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(1)H-ENDOR Evidence for a Hydrogen Bonding Interaction that Modulates the Reactivity of a Non-heme Fe(IV)=O Unit

We report that a novel use of 35 GHz (1)H-ENDOR spectroscopy establishes the presence in 1 of an Fe(IV)=O···H–O–Fe(III) hydrogen bond predicted by DFT computations to generate a six-membered-ring core for 1. The H-bond rationalizes the difference in C–H bond cleavage reactivity between 1 and 4(OCH(3...

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Autors principals: Shanmugam, Muralidharan, Xue, Genqiang, Que, Lawrence, Hoffman, Brian M.
Format: Artigo
Idioma:Inglês
Publicat: 2012
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC3482979/
https://ncbi.nlm.nih.gov/pubmed/22984805
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ic3015783
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