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几何异构对杂环金属化铱(III)配合物发光行为的影响。

Effects of geometrical isomerism on emissive behaviour of heteroleptic cyclometalated Ir(III) complexes.

作者信息

Jinsenji Yoshiki, Takimoto Kazuyoshi, Yoshida Jun, Mori Shigeki, Watanabe Yutaka, Sato Hisako

机构信息

Graduate School of Science and Engineering, Ehime University, Matsuyama 790-8577, Japan.

出版信息

Dalton Trans. 2021 Jun 22;50(24):8506-8511. doi: 10.1039/d1dt00783a.

DOI:10.1039/d1dt00783a
PMID:34052843
Abstract

In this study, we report the emissive properties of a heteroleptic cyclometalated Ir(iii) complex, [Ir(bzq)2(PBO)] (bzqH = benzo[h]quinoline; PBOH = 2-(2-hydroxyphenyl)benzoxazole). The complex, [Ir(C^N)2(N^O)], was synthesised and optically resolved using a chiral column. Two geometrical isomers, trans-(N,N) and cis-(N,N) isomers, were obtained as the major and minor products in an enantiopure form, respectively. Their molecular structures were determined using single crystal X-ray analysis. In the crystalline states, the intermolecular C-Hπ interaction between PBO- and an H atom in bzq- was the main factor influencing molecular packing. When the complexes were dissolved in CH2Cl2 and excited at 430 nm under N2 atmosphere, yellow (λmax = 550 nm) and orange emissions (λmax = 570 nm) were observed for the trans-(N,N) and cis-(N,N) isomers, respectively, with the quantum yield higher for the former than the latter.

摘要

在本研究中,我们报道了一种杂配环金属化铱(III)配合物[Ir(bzq)2(PBO)](bzqH = 苯并[h]喹啉;PBOH = 2-(2-羟基苯基)苯并恶唑)的发光性质。该配合物[Ir(C^N)2(N^O)]通过手性柱进行合成和光学拆分。获得了两种几何异构体,反式-(N,N)和顺式-(N,N)异构体,分别作为对映体纯形式的主要和次要产物。使用单晶X射线分析确定了它们的分子结构。在晶体状态下,PBO-与bzq-中的一个H原子之间的分子间C-Hπ相互作用是影响分子堆积的主要因素。当配合物溶解在二氯甲烷中并在氮气气氛下于430 nm处激发时,反式-(N,N)和顺式-(N,N)异构体分别观察到黄色发射(λmax = 550 nm)和橙色发射(λmax = 570 nm),前者的量子产率高于后者。

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