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Metal–CO Bonding in Mononuclear Transition Metal Carbonyl Complexes

[Image: see text] DFT calculations have been carried out for coordinatively saturated neutral and charged carbonyl complexes [M(CO)(n)](q) where M is a metal atom of groups 2–10. The model compounds M(CO)(2) (M = Ca, Sr, Ba) and the experimentally observed [Ba(CO)](+) were also studied. The bonding...

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Detalles Bibliográficos
Autores principales: Frenking, Gernot, Fernández, Israel, Holzmann, Nicole, Pan, Sudip, Krossing, Ingo, Zhou, Mingfei
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2021
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8395605/
https://www.ncbi.nlm.nih.gov/pubmed/34467324
http://dx.doi.org/10.1021/jacsau.1c00106