C–H Bond Activation by Iridium(III) and Iridium(IV) Oxo Complexes

2023 | journal article. A publication with affiliation to the University of Göttingen.

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​C–H Bond Activation by Iridium(III) and Iridium(IV) Oxo Complexes​
Tepaske, M. A.; Fitterer, A.; Verplancke, H.; Delony, D.; Neben, M. C.; de Bruin, B. & Holthausen, M. C. et al.​ (2023) 
Angewandte Chemie International Edition, art. e202316729​.​ DOI: https://doi.org/10.1002/anie.202316729 

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Authors
Tepaske, Martijn Alexander; Fitterer, Arnd; Verplancke, Henrdik; Delony, Daniel; Neben, Marc C.; de Bruin, Bas; Holthausen, Max C.; Schneider, Sven
Abstract
Oxidation of an iridium(III) oxo precursor enabled the structural, spectroscopic, and quantum‐chemical characterization of the first well‐defined iridium(IV) oxo complex. Side‐by‐side examination of the proton‐coupled electron transfer thermochemistry revealed similar driving forces for the isostructural oxo complexes in two redox states due to compensating contributions from H+ and e– transfer. However, C–H activation of dihydroanthracene revealed significant hydrogen tunnelling for the distinctly more basic iridium(III) oxo complex. Our findings complement the growing body of data that relate tunnelling to ground state properties as predictors for the selectivity of C–H bond activation.
Issue Date
2023
Journal
Angewandte Chemie International Edition 
ISSN
1433-7851
eISSN
1521-3773
Language
English

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