Title of article
Ab initio conformational study of 2,2′:5′,2″-terthiophene
Author/Authors
Ciofalo، نويسنده , , Maurizio and Manna، نويسنده , , Gianfranco La، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1996
Pages
6
From page
73
To page
78
Abstract
The conformers of 2,2′:5′,2″-terthiophene were determined through ab initio MO full geometry optimization with a 6-31G* basis set. Different minima were found corresponding to twisted anti, anti, syn, anti and syn, syn structures. An estimate of the interconversion rate between conformers was performed.
Journal title
Chemical Physics Letters
Serial Year
1996
Journal title
Chemical Physics Letters
Record number
1778952
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