期刊
DYES AND PIGMENTS
卷 86, 期 3, 页码 238-248出版社
ELSEVIER SCI LTD
DOI: 10.1016/j.dyepig.2010.01.010
关键词
Benzothiazole; Bipolar; Optical; Chemical calculation; Electrochemical; pi-Bridge
资金
- National Natural Science Foundation of China [20672079]
- Nature Science Key Basic Research of Jiangsu Province for Higher Education [06KJA15007]
- Natural Science Foundation of Jiangsu Province [BK2006048]
- Nature Science of Jiangsu Province for Higher Education [05KJB150116]
- Specialized Research Fund for the Doctoral Program of Higher Education [20060285001]
- Key Laboratory of Organic Synthesis of Jiangsu Province [JSK008]
Novel bipolar benzothiazole-based derivatives with various pi-electron donors were synthesized and characterized using H-1 and C-13 NMR and mass spectrometry; their thermal, optical and electrochemical properties were also investigated. Optoelectronic properties are reported and discussed in terms of the distribution of the highest occupied molecular orbital and the lowest unoccupied molecular orbital and the conjugative pathway between the electron-donating moieties and electron-accepting moieties. The compounds exhibited high fluorescence quantum yield, desirable HOMO levels and high thermal stability. Quantum chemical calculations were used to study optimized ground-state geometry as well as spatial distributions of HOMO and LUMO levels of the compounds. (C) 2010 Elsevier Ltd. All rights reserved.
作者
我是这篇论文的作者
点击您的名字以认领此论文并将其添加到您的个人资料中。
推荐
暂无数据