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Scrutinizing metal–ligand covalency and redox non-innocence via nitrogen K-edge X-ray absorption spectroscopy

Nitrogen K-edge X-ray absorption spectra (XAS) were obtained for 19 transition metal complexes bearing bipyridine, ethylenediamine, ammine, and nitride ligands. Time-dependent density functional theory (TDDFT) and DFT/restricted open configuration interaction singles (DFT/ROCIS) calculations were fo...

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Detalles Bibliográficos
Autores principales:	Lukens, James T., DiMucci, Ida M., Kurogi, Takashi, Mindiola, Daniel J., Lancaster, Kyle M.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Royal Society of Chemistry 2019
Materias:	Chemistry
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6530532/ https://www.ncbi.nlm.nih.gov/pubmed/31183055 http://dx.doi.org/10.1039/c8sc03350a

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