Al<sub>2</sub>C<sub>4</sub>H<sub>2</sub> Isomers with the Planar Tetracoordinate Carbon (ptC)/Aluminum (ptAl)

Al<sub>2</sub>C<sub>4</sub>H<sub>2</sub> Isomers with the Planar Tetracoordinate Carbon (ptC)/Aluminum (ptAl)

Forty-one isomers of Al<sub>2</sub>C<sub>4</sub>H<sub>2</sub> that lie within 50 kcal mol<sup>−1</sup> are theoretically identified in this work using density functional theory. Among these, isomers <b>3</b> and <b>14</b> contai...

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Bibliographic Details
Main Authors: Abdul Hamid Malhan, Sony Sobinson, Nisha Job, Shilpa Shajan, Surya Prakash Mohanty, Venkatesan S. Thimmakondu, Krishnan Thirumoorthy
Format: Article
Language:English
Published: MDPI AG 2022-10-01
Series:Atoms
Subjects:
Al<sub>2</sub>C<sub>4</sub>H<sub>2</sub>
planar tetracoordinate carbon
planar tetracoordinate aluminum
delocalization
anti-van’t Hoff–Le Bel
computational chemistry
Online Access:https://www.mdpi.com/2218-2004/10/4/112

Internet

https://www.mdpi.com/2218-2004/10/4/112

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