Semi-empirical evaluation of substituted terthiophenes as polythiophene precursors

Stanforth, Stephen (1999) Semi-empirical evaluation of substituted terthiophenes as polythiophene precursors. Journal of Heterocyclic Chemistry, 36 (1). pp. 137-140. ISSN 0022-152X

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Official URL: http://dx.doi.org/10.1002/jhet.5570360120

Abstract

PM3 Semi-empirical molecular orbital calculations have been performed on terthiophene derivatives which are also heteropentalene mesomeric betaines. The ionization potentials and band-gaps have been determined in order to identify systems which might provide suitable monomers for conducting polythiophene derivatives.

Item Type: Article
Subjects: F100 Chemistry
Department: Faculties > Health and Life Sciences > School of Life Sciences > Applied Sciences
Depositing User: Becky Skoyles
Date Deposited: 16 Feb 2015 10:12
Last Modified: 10 Aug 2015 11:52
URI: http://nrl.northumbria.ac.uk/id/eprint/19096

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