期刊
DYES AND PIGMENTS
卷 88, 期 3, 页码 385-390出版社
ELSEVIER SCI LTD
DOI: 10.1016/j.dyepig.2010.08.011
关键词
Donor; Acceptor; Push-Pull; Rhodanine; Dyes
资金
- COLCIENCIAS (Colombia)
- Universidad del Valle (Colombia)
- Spanish Ministerio de Educacion y Ciencia (MEC)
The push-pull behaviour of novel 2-(11-dicyanomethylene)rhodanines bearing an electron donor N N-dimethylaniline or tetrathiafulvalene group on the C-5 of the heterocyclic ring was studied using experimental (electrochemical and spectroscopical analysis) and theoretical (DFT/B3LYP/631G*) methods Calculations showed a remarkable push pull trend with the HOMO mainly located on the donor moiety and the LUMO on the acceptor dicyanomethylene moiety In agreement with the theoretical predictions a solvatochromic behavior intramolecular charge transfer band was observed in the visible region (C) 2010 Elsevier Ltd All rights reserved
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