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| 两种咔唑衍生物的结构、光学性质及理论计算(英文) | |
| 引用本文： | 甘小平,李先磊,唐诗雅,耿文倩,徐国义,孔林,周虹屏,吴杰颖,田玉鹏.两种咔唑衍生物的结构、光学性质及理论计算(英文)[J].安徽大学学报(自然科学版),2010,34(3). |
| 作者姓名： | 甘小平 李先磊 唐诗雅 耿文倩 徐国义 孔林 周虹屏 吴杰颖 田玉鹏 |
| 作者单位： | 1. 安徽大学,化学化工学院,功能无机材料安徽省重点实验室,安徽,合肥,230039;安徽农业大学,理学院应用化学系,安徽,合肥,230036 2. 安徽大学,化学化工学院,功能无机材料安徽省重点实验室,安徽,合肥,230039 3. 安徽大学,化学化工学院,功能无机材料安徽省重点实验室,安徽,合肥,230039;山东大学,晶体材料国家重点实验室,山东,济南,250100;南京大学,配位化学国家重点实验室,江苏,南京,210093 |
| 基金项目： | 国家自然科学基金，教育部高等学校博士学科点专项科研基金，安徽省教育厅科研基金资助项目，安徽省优秀青年科技基金资助项目 |
| 摘 要： | 通过Suzuki反应,合成了两种新型的咔唑衍生物:9-己基-3,6-二(2-噻吩)咔唑(1)和9-己基-3,6-二苯咔唑(2),并利用1HNMR、13C NMR、IR、MS和X-射线单晶衍射对它们的结构进行了表征.同时,利用紫外可见光谱、单光子荧光激发谱和理论计算对它们的光学性质进行了研究,结果表明:测量的单光子吸收性能和理论计算的结果比较符合;并进一步对它们的双光子吸收截面进行了理论预测:分别为177.51GM(1)和191.55 GM(2). |
| 关 键 词： | 结构 光学性质 咔唑衍生物 |
Structure, calculation and optical properties of two carbazole derivatives |
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| GAN Xiao-ping,LI Xian-lei,TANG Shi-ya,GENG Wen-qian,XU Guo-yi,KONG Lin,ZHOU Hong-ping,WU Jie-ying,TIAN Yu-peng.Structure, calculation and optical properties of two carbazole derivatives[J].Journal of Anhui University(Natural Sciences),2010,34(3). | |
| Authors: | GAN Xiao-ping LI Xian-lei TANG Shi-ya GENG Wen-qian XU Guo-yi KONG Lin ZHOU Hong-ping WU Jie-ying TIAN Yu-peng |
| Abstract: | Two new carbazole derivatives, 9-(hex-1-yl)-3, 6-di (thien-2-yl) carbazole and 9-(hex-1-yl)-3, 6-di (phen-2-yl) carbazole were synthesized by Suzuki reaction. Their structures were characterized by 1H NMR, 13C NMR IR, MS and single crystal X-ray diffraction. UV and single-photon excited fluorescence of the two compounds were investigated by experiment. The calculated one-photon absorption properties were in good agreement with the experimental measurement, and the calculated two-photon absorption cross-sections of the two compounds by quantum chemical method were 177.51 GM for 1 and 191.55 GM for 2 respectively. |
| Keywords: | structure optical properties carbazole derivatives |
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