The Bursten model of ligand additivity applied to orbital energetics of octahedral d6 phosphine complexes

[Display omitted] •The Bursten Model correctly describes energetics of dπ orbitals in d6 octahedral phosphine complexes.•PF3, PCl3, PH3, PMe3, P(OMe)3 and PPh3 are ranked according to π-acceptor ability.•PF3 and PCl3 are found to be similar to CO in π-acceptor ability in Cr(0) and Mn(I) complexes.•O...

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Veröffentlicht in:	Inorganica Chimica Acta 2020-03, Vol.502, p.119349, Article 119349
1. Verfasser:	Graham, John P.
Format:	Artikel
Sprache:	eng
Schlagworte:	Coordination compounds Density functional theory Ligand additivity Ligands Molecular orbitals Oxidation Phosphine complexes Phosphines
Online-Zugang:	Volltext
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