Computational Studies of cis– and trans–Isomer Preferences of Low-Spin d6 [M(DABF)2A2]+ and [M(CO)4A2]+ Complexes (M = Co, Rh, Ir; A = Anionic Ligand): Spectator Ligand π-Backbonding and DFT Exchange

Publication date: Available online 24 March 2021Source: Computational and Theoretical ChemistryAuthor(s): Samantha M. Bacchi, Cara M. Waters, Oreoluwa A. Agunoye Jones, Greg Becker, Alexander P. Bryan, Tyler D. Easter, Mykayla G. Evans, Jessica M. Farace, Kristopher D. Johnson, Julian M. Kasse, Zane R. LaCasse, Nancy M. Aguillon Perea, Abraham J. LaMontagne, Ryan M. Miller, Kenneth W. Mundorf, Fotis G. Pappas, Konstantinos G. Pappas, Victoria L. Pho, Christopher T. Potocki, Megan A. Polz

Source: Computational and Theoretical Chemistry - March 26, 2021 Category: Chemistry Source Type: research