School of Chemistry and Chemical Engineering, Jiangsu Normal University, Jiangsu Key Laboratory of Green Synthetic for Functional Materials, Xuzhou 221116, China.
Spectrochim Acta A Mol Biomol Spectrosc. 2013 Feb 15;103:62-7. doi: 10.1016/j.saa.2012.10.075. Epub 2012 Nov 7.
A series of entirely new framework chromeno[4,3,2-de][1,6]naphthyridine derivatives containing carbazole groups have been carefully designed and prepared. The relationship of photoluminescence property and structure of these compounds was systematically investigated via UV-vis, fluorescence and electrochemical analyzer. The HOMO and LUMO distributions of these compounds were calculated by density functional theory (DFT) (B3LYP; 6-31G(∗)) method. These compounds exhibited high fluorescence quantum yields, desirable HOMO levels and high thermal stability, indicating that the combination of chromeno[4,3,2-de][1,6]naphthyridine and carbazole could be an efficient means to enhance hole-transporting ability and fluorescent quantum yield.
一系列全新的含咔唑基团的框架色烯[4,3,2-de][1,6]萘啶衍生物已被精心设计和制备。通过紫外可见分光光度计、荧光分光光度计和电化学分析仪系统地研究了这些化合物的光致发光性能与结构之间的关系。通过密度泛函理论(DFT)(B3LYP;6-31G(∗))方法计算了这些化合物的 HOMO 和 LUMO 分布。这些化合物表现出高荧光量子产率、理想的 HOMO 能级和高热稳定性,表明色烯[4,3,2-de][1,6]萘啶和咔唑的结合是增强空穴传输能力和荧光量子产率的有效手段。