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一些杂化铱(III)配合物中 LC 和 MLCT 激发态之间存在强混合的证据。

Evidence for strong mixing between the LC and MLCT excited states in some heteroleptic iridium(III) complexes.

机构信息

Department of Chemistry, Annamalai University, Annamalainagar 608002, Tamilnadu, India.

出版信息

J Fluoresc. 2011 Jul;21(4):1585-97. doi: 10.1007/s10895-011-0847-x. Epub 2011 Jan 28.

DOI:10.1007/s10895-011-0847-x
PMID:21274601
Abstract

The synthesis, structure and photophysical properties of series of new luminescent cyclometalated Iridium (III) complexes are reported. The cyclometalated ligand used here is 2-aryl imidazole and the auxiliary ligand is acetyl acetone (acac). The crystal structure of the complex (dmdpi)(2)Ir(acac) (5) show that the Iridium(III) ion resides in a distorted octahedral environment. All complexes exhibit bright photoluminescence (PL) at room temperature and (fpdmdmpi)(2)Ir(acac) 4 has a high solution PL quantum efficiency of 0.56. The role played by electron releasing and electron withdrawing substituents of the 2-arylimidazole ligands towards the stability of HOMO and how the substituent influences the luminescent behaviour are discussed. Furthermore those substituents have effect on the contribution to mixing between (3)(π-π*) and (3)(MLCT) for the lowest excited states.

摘要

本文报道了一系列新型发光的金属环戊二烯铱(III)配合物的合成、结构和光物理性质。所用的金属环戊二烯配体为 2-芳基咪唑,辅助配体为乙酰丙酮(acac)。配合物(dmdpi)(2)Ir(acac)(5)的晶体结构表明,铱(III)离子位于扭曲的八面体环境中。所有配合物在室温下均表现出明亮的光致发光(PL),(fpdmdmpi)(2)Ir(acac)4 的溶液 PL 量子效率高达 0.56。讨论了 2-芳基咪唑配体的供电子和吸电子取代基对 HOMO 稳定性的作用,以及取代基如何影响发光行为。此外,这些取代基对最低激发态中(3)(π-π*)和(3)(MLCT)之间混合的贡献有影响。

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本文引用的文献

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