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Some properties of cyclacenes and silacyclacenes
Date
1997-04-01
Author
Türker, Burhan Lemi
Celebi, N
Metadata
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This work is licensed under a
Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International License
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Various Huckel type cyclacenes and silacyclacenes are subject to semi-empirical molecular orbital treatment at the level of AMI type. Cyclacenes having silicon atom at the peri and fusion points of arenoid rings as well as all-silated cyclacenes are considered. The cryptoannulenic effects, frontier molecular orbital energies, geometries and polarizabilities of these structures have been examined.
Subject Keywords
Polarizability
,
FMO energies
,
AM1 calculations
,
Monosilacyclacenes
,
Silacyclacenes
,
Cyclacenes
URI
https://hdl.handle.net/11511/62617
Journal
BULLETIN DES SOCIETES CHIMIQUES BELGES
Collections
Department of Chemistry, Article