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Theoretical Analysis of the Smallest Carbon Cluster Containing a Planar Tetracoordinate Carbon

✍ Scribed by Merino, Gabriel; Méndez-Rojas, Miguel A.; Beltrán, Hiram I.; Corminboeuf, Clemence; Heine, Thomas; Vela, Alberto

Book ID
126105821
Publisher
American Chemical Society
Year
2004
Tongue
English
Weight
893 KB
Volume
126
Category
Article
ISSN
0002-7863

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## Abstract A series of cyclic hydrocarbons analogs where a carbon displays unusual planar tetracoordinate structure is proposed, employing hybrid density functional theory calculations using B3LYP functional and 6‐311+G\*\* basis set. Various strategies were employed to design the neutral planar t