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Synthesis,photophysical properties and TD-DFT calculation of four two-photon absorbing triphenylamine derivatives 被引量:3
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作者 KONG Lin YANG JiaXiang +7 位作者 ZHOU HongPing LI ShengLi HAO FuYing ZHANG Qiong TU YuLong WU JieYing XUE ZhaoMing TIAN YuPeng 《Science China Chemistry》 SCIE EI CAS 2013年第1期106-116,共11页
In this study,linear absorption,single-photon excited fluorescence,fluorescence quantum yields,fluorescence lifetime and two-photon excited fluorescence of a series of triphenylamine derivatives (L1,L2,L3 and L4) have... In this study,linear absorption,single-photon excited fluorescence,fluorescence quantum yields,fluorescence lifetime and two-photon excited fluorescence of a series of triphenylamine derivatives (L1,L2,L3 and L4) have been measured.L1 and L3 are D--A type dyes,while L2 and L4 are D--D--A type dyes (D=donor,A=acceptor).The investigated compounds consist of triphenylamine-bearing donor-substituted and/or systematically extended-conjugated length,which are designed to gain insight into the effect of the ethoxyl unit and-linkage length on the linear and nonlinear optical properties.The influence of solvent polarity on the photophysical properties was investigated.Employing time-dependent density functional theory (TD-DFT) calculations,the structure-property relationships are discussed. 展开更多
关键词 triphenylamine derivatives optical properties structure-property relationship TD-DFT calculation
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Application of phenonaphthazine derivatives as hole-transporting materials for perovskite solar cells
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作者 Xueyuan Liu Fei Zhang +5 位作者 Xicheng Liu Mengna Sun Shirong Wang Dongmei Li Qingbo Meng Xianggao Li 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2016年第4期702-708,共7页
Two electron-rich, solution-processable phenonaphthazine derivatives, 5,12-bis(N-[4,4'-bis-(phenyl) aminophen-4 ''-yl]}-phenonaphthazine (BPZTPA) and 5,12-bis{N-[4,4'-bis(methoxy-phenyl)aminophen-4'... Two electron-rich, solution-processable phenonaphthazine derivatives, 5,12-bis(N-[4,4'-bis-(phenyl) aminophen-4 ''-yl]}-phenonaphthazine (BPZTPA) and 5,12-bis{N-[4,4'-bis(methoxy-phenyl)aminophen-4'-phenonaphthazine (MeO-BPZTPA) have been designed and employed in the fabrication of perovskite solar cells. BPZTPA and MeO-BPZTPA exhibit excellent thermal stabilities, hole mobilities (similar to 10(-4) cm(2)/(V.s)) and suitable HOMO levels (-5.34 and-5.29 eV, respectively) relative to the valence band of the CH3NH3PbI3 and Au work function, showing their potential as alternative hole-transporting materials (HTMs). Meanwhile, the corresponding mesoporous TiO2/CH3NH3PbI3/HTM/Au devices are investigated, and the best power conversion efficiency of 10.36% has been achieved for MeO-BPZTPA without using p-type dopant. (C) 2016 Science Press and Dalian Institute of Chemical Physics, Chinese Academy of Sciences. Published by Elsevier B.V. and Science Press. All rights reserved. 展开更多
关键词 Perovskite solar cell Phenonaphthazine Hole-transporting material triphenylamine derivatives
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Synthesis, Crystal Structure and Luminescent Properties of 2-(4-Amino-phenyl)-3-(4-(diphenylamino)phenyl)acrylonitrile 被引量:2
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作者 任军 杨鹏 +4 位作者 孙微韬 黄建炎 孔林 杨家祥 田玉鹏 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 2013年第4期590-594,共5页
A novel triphenylamine derivative, 2-(4-aminophenyl)-3-(4-(diphenylamino)phen- yl) acrylonitrile (L), was synthesized and characterized by NMR spectra and X-ray diffraction analysis. Compound L crystallizes in... A novel triphenylamine derivative, 2-(4-aminophenyl)-3-(4-(diphenylamino)phen- yl) acrylonitrile (L), was synthesized and characterized by NMR spectra and X-ray diffraction analysis. Compound L crystallizes in monoclinic, space group P21/n with a = 17.120(12), b = 6.753(5), c = 20.380(15) A, β = 113.043(8)°, Mr = 387.47, V= 2168(3)A3, Z= 4, Dc = 1.187 g/cm3, μ = 0.071 mm-1, F(000) = 816, R = 0.0475 and wR = 0.1410 for 16102 observed reflections (I 〉 2σ(I)). In the crystal structure, compound L was found to form antiparallel dimer stacks due to its specific intermolecular interactions, including C-H...N and N-H...π interactions. Fluorescence and thermal studies indicate that compound L has good optical properties and thermal stability. 展开更多
关键词 D-π-D molecule crystal structure triphenylamine derivative
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Triphenylamine-based highly active two-photon absorbing chromophores with push-pull systems
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作者 Yanqi Ban Linhong Hao +3 位作者 Zhenbo Peng Lishui Sun Lihua Teng Yingjie Zhao 《Chinese Chemical Letters》 SCIE CAS CSCD 2023年第7期444-448,共5页
Two triphenylamine-based star-type push-pull chromophores(T1, T2) were designed and synthesized.Triphenylamine serves as the central core and acts as an electron-donating group surrounded by electronwithdrawing pentaf... Two triphenylamine-based star-type push-pull chromophores(T1, T2) were designed and synthesized.Triphenylamine serves as the central core and acts as an electron-donating group surrounded by electronwithdrawing pentafluorobenzene or N,N-dimethyl substituted tetrafluorobenzene, which are connected by ethylene bridges. Single-crystal X-ray diffraction confirmed the structures and molecular arrangement of two chromophores. The systematic photophysical research of T1 and T2 absorption characteristics was carried out to gain a better understanding of how structure-property relationships affect the observed nonlinear optical absorption phenomenon. Complementary calculations based on density functional theory(DFT) further confirmed the experimental results. Both chromophores exhibited excellent two-photon absorption(TPA) properties in CH_(2)Cl_(2). Notably, T2 has more remarkable nonlinear optical absorption effects with the TPA cross-section up to 4.24 × 10~7GM. By adjusting the electronic structures of the chromophores through introducing pentafluorobenzene or N,N-dimethyl as functional groups with different electron-donating or withdrawing behaviors, the TPA performance of the small organic molecule could be greatly enhanced. These molecular structures with push-pull systems were excellent candidates for different two-photon applications. 展开更多
关键词 Star-type chromophores triphenylamine derivatives Two-photon absorption Nonlinear optical materials Push-pull systems
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