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CAl11−: a molecular rotor with a quasi-planar tetracoordinate carbon.

Authors :
Bai, Li-Xia
Barroso, Jorge
Orozco-Ic, Mesías
Ortiz-Chi, Filiberto
Guo, Jin-Chang
Merino, Gabriel
Source :
Chemical Communications. 4/28/2023, Vol. 59 Issue 33, p4966-4969. 4p.
Publication Year :
2023

Abstract

In this work, we analyzed the bonding and fluxional character of the global minimum of CAl11−. Its structure is formed by two stacked layers, one of them resembles the well-known planar tetracoordinate carbon CAl4 on top of a hexagonal Al@Al6 wheel. Our results show that the CAl4 fragment rotates freely around the central axis. The exceptional stability and fluxionality of CAl11− derive from its particular electron distribution. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
13597345
Volume :
59
Issue :
33
Database :
Academic Search Index
Journal :
Chemical Communications
Publication Type :
Academic Journal
Accession number :
163225340
Full Text :
https://doi.org/10.1039/d3cc00855j