Investigations of a Copper(II) Bipyridyl-N-Heterocyclic Carbene Macrocycle for CO2 Reduction: Apparent Formation of an Imidazolium Carboxylate Intermediate Leading to Demetalation.
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ABSTRACT: A copper complex supported by a redox-active bipyridyl-N-heterocyclic carbene based ligand framework is reported. From X-ray crystallography, the tetradentate macrocycle provides a distorted square planar geometry around the copper metal center. The complex was investigated for the electrocatalytic CO2 reduction reaction (CO2RR) in acetonitrile solutions. Electronic structure calculations were performed on the complex and associated intermediates to provide a fundamental understanding of the metal-ligand redox chemistry and are compared to the previously reported nickel and cobalt analogues. Unlike its predecessors, which are active catalysts for the CO2RR, the copper complex decomposes under reducing conditions in the presence of CO2. A n
SUBMITTER: Sahil ST
PROVIDER: S-EPMC11325401 | biostudies-literature | 2024 Aug
REPOSITORIES: biostudies-literature
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