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Polyhedral Ferraboranes with Iron Carbonyl Vertices: Carbonyl Migration Processes in the Iron Tetracarbonyl Derivatives

[Image: see text] The structures and energetics of the neutral B(n–1)H(n–1)Fe(CO)(x) (x = 4, 3) and the dianions [B(n–1)H(n–1)Fe(CO)(3)](2–) (n = 6–14) have been investigated by density functional theory. The low-energy structures of the tricarbonyl dianions [B(n–1)H(n–1)Fe(CO)(3)](2–) are all found...

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Detalles Bibliográficos
Autores principales: Attia, Amr A. A., Lupan, Alexandru, King, R. Bruce
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10364080/
https://www.ncbi.nlm.nih.gov/pubmed/37433263
http://dx.doi.org/10.1021/acs.jpca.3c02944