Spectroscopic and Computational Studies of an End-on Bound Superoxo-Cu(II) Complex: Geometric and Electronic Factors that Determine the Ground State

A variety of techniques including absorption, magnetic circular dichroism (MCD), variable-temperature, variable-field MCD (VTVH-MCD), and resonance Raman (rR) spectroscopies are combined with density function theory (DFT) calculations to elucidate the electronic structure of the end-on (η(1)) bound...

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Main Authors: Woertink, Julia S., Tian, Li, Maiti, Debabrata, Lucas, Heather R., Himes, Richard A., Karlin, Kenneth D., Neese, Frank, Würtele, Christian, Holthausen, Max, Bill, Eckhard, Sundermeyer, Jörg, Schindler, Siegfried, Solomon, Edward I.
Formato: Artigo
Idioma:Inglês
Publicado em: 2010
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Article
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC2963092/
https://ncbi.nlm.nih.gov/pubmed/20857998
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ic101138u
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