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Iridium(VII)–Corrole Terminal Carbides Should Exist as Stable Compounds

[Image: see text] Scalar-relativistic DFT calculations with multiple exchange-correlation functionals and large basis sets foreshadow the existence of stable iridium(VII)–corrole terminal carbide derivatives. For the parent compound Ir[Cor](C), OLYP/STO-TZ2P calculations predict a short Ir–C bond di...

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Detalles Bibliográficos
Autores principales: Conradie, Jeanet, Alemayehu, Abraham B., Ghosh, Abhik
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9955125/
https://www.ncbi.nlm.nih.gov/pubmed/36855452
http://dx.doi.org/10.1021/acsorginorgau.1c00029