Theoretical Analysis of Mechanistic Pathways for Hydrogen Evolution Catalyzed by Cobaloximes

The mechanistic pathways for hydrogen evolution catalyzed by cobalt complexes with supporting diglyoxime ligands are analyzed with computational methods. The cobaloximes studied are Co(dmgBF2)2 (dmg = dimethylglyoxime) and Co(dpgBF2)2 (dpg = diphenylglyoxime) in acetonitrile. The reduction potential...

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Veröffentlicht in:	Inorganic chemistry 2011-11, Vol.50 (21), p.11252-11262
Hauptverfasser:	Solis, Brian H, Hammes-Schiffer, Sharon
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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