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Maximum Overlap Molecular Orbitals in Square Pyramidal (CH)5+ Cation

King-Mo Sun ; Department of Chemistry, The Chinese University of Hong Kong, Shatin, N. T ., Hong Kong
Wai-Kee Li ; Department of Chemistry, The Chinese University of Hong Kong, Shatin, N. T ., Hong Kong


Puni tekst: engleski pdf 3.178 Kb

str. 75-81

preuzimanja: 93

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Sažetak

Applying the maximum overlap criterion, the localized molecular
orbitals of square pyramidal (CH)/ cation have been determined.
The resulting multi-center bonding orbitals are examined
in detail. In addition, the basal C-C and all C-H bonds are compared
with those of the more familiar systems, e. g., cyclobutane
and cyclobutene.

Ključne riječi

Hrčak ID:

196416

URI

https://hrcak.srce.hr/196416

Posjeta: 248 *