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Chemical bonding and dynamic structural fluxionality of a boron-based Al(2)B(8) binary cluster: the robustness of a doubly 6π/6σ aromatic [B(8)](2−) molecular wheel

Despite the isovalency between Al and B elements, Al-doping in boron clusters can deviate substantially from an isoelectronic substitution process. We report herein on a unique sandwich di-Al-doped boron cluster, Al(2)B(8), using global structural searches and quantum chemical calculations. The clus...

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Detalles Bibliográficos
Autores principales: Yue, Rong-Xin, Gao, Shu-Juan, Han, Peng-Fei, Zhai, Hua-Jin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9833104/
https://www.ncbi.nlm.nih.gov/pubmed/36712639
http://dx.doi.org/10.1039/d2ra07268h