Metal–ligand covalency of C–H activating iridium complexes from L-edge valence-to-core resonant inelastic X-ray scattering

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Authors: Raphael M. Jay, Ambar Banerjee, Marco Reinhard, Huan Zhao, Nils Huse, Kelly J. Gaffney, Thomas Kröll, Dimosthenis Sokaras, Philippe Wernet
Cited by: 2
References: 62

Abstract

covalent metal-ligand interactions for different ancillary ligands modulate charge densities at the central metal atom. The selectivity of our methods to the valence-excited state manifold allows us to observe and quantify shifts in the d-d and charge-transfer manifold of excited-states, which are both thought to influence the yield of photochemical C-H bond activation. Our combined experimental and theoretical study of this series of iridium complexes reveals the interplay of ligand structure, metal-ligand bonding or covalency and valence-excited state landscape, which allows to deduce a general understanding of how these properties impact photochemical pathways and reactivity in C-H activation and other photocatalytic applications.

Fields of Study & Subjects

Organometallic Complex Synthesis and Catalysis Catalytic C–H Functionalization Methods Metal-Catalyzed Oxygenation Mechanisms

Publication details

Journal / source
Chemical Science
Publisher
Royal Society of Chemistry (RSC)
Volume
17
Issue
15
Pages
7609–7619
Publication date
1 January 2026
Language
EN