Revisiting Formal Copper(III) Complexes: Bridging Perspectives with Quasi‐d10 Configurations

The formal Cu(III) complex [Cu(CF3)4]1− has often served as a paradigmatic example of challenging oxidation state assignment – with many reports proposing conflicting descriptions. Here we report a computational analysis of this compound, employing Energy Decomposition Analysis and Intrinsic Bond Or...

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Veröffentlicht in:	European journal of inorganic chemistry 2022-09, Vol.2022 (27), p.n/a
Hauptverfasser:	Leach, Isaac F., Havenith, Remco W. A., Klein, Johannes E. M. N.
Format:	Artikel
Sprache:	eng
Schlagworte:	Bonding theory Computational chemistry Copper Electronic structure Inorganic chemistry Oxidation Oxidation states Population analysis Transition metals Valence
Online-Zugang:	Volltext
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