Electronic structure description of the mu(4)-sulfide bridged tetranuclear Cu(Z) center in N(2)O reductase

Citation:
Electronic structure description of the mu(4)-sulfide bridged tetranuclear Cu(Z) center in N(2)O reductase, Chen, P., DeBeer George S., Cabrito I., Antholine W. E., Moura J. J., Moura I., Hedman B., Hodgson K. O., and Solomon E. I. , J Am Chem Soc, Feb 6, Volume 124, Number 5, p.744-5, (2002)

Abstract:

Spectroscopy coupled with density functional calculations has been used to define the spin state, oxidation states, spin distribution, and ground state wave function of the mu4-sulfide bridged tetranuclear CuZ cluster of nitrous oxide reductase. Initial insight into the electronic contribution to N2O reduction is developed, which involves a sigma superexchange pathway through the bridging sulfide.

Notes:

0002-7863 (Print)0002-7863 (Linking)Journal ArticleResearch Support, Non-U.S. Gov'tResearch Support, U.S. Gov't, Non-P.H.S.Research Support, U.S. Gov't, P.H.S.

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