Article ID Journal Published Year Pages File Type
5395233 Computational and Theoretical Chemistry 2011 6 Pages PDF
Abstract
Molecules containing Planar Tetracoordinate Carbon (PTC) are of great interest. C52- seems to be the simplest species which include a PTC. In this regard, Hoffmann, Vela and coworkers (P.D. Pancharatna, M.A. Mendez-Rojas, G. Merino, A. Vella, R. Hoffmann, J. Am. Chem. Soc. 126 (2004) 15309) have suggested PTC chains and lattices of simple C52- unit in which metal ions are employed to compensate the negative charge. In this account, structures of dimers and trimers beside tetramers containing earth alkali metals have been investigated to check whether they can be employed for this goal. Upon the obtained results one may conclude that thermodynamic instability of these species is a stumbling block.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
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