五种基于氢键相互作用的镧系配合物:荧光性质,热分析和DFT计算

IF 3.2 3区 化学 Q2 CHEMISTRY, INORGANIC & NUCLEAR
Zi-He Song , Zi-Yi Qu , Jin-Jin Zhao , Ning Ren , Jian-Jun Zhang
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引用次数: 0

摘要

在室温下合成了5种新型配合物,具体分子式如下:[Ln(4- fba)3(5,5′- dm -2,2′-bipy)(H2O)]2, (Ln = Sm(1), Tb(2), Eu(3),Gd(4));[Ln (4-FBA) 3(5、5 ' -DM-2 2 ' -bipy)] 2·6 (H2O) * 2(介绍)* 2 (5 5 ' -DM-2 2 ' -bipy), (Ln =呃(5);4-FBA = 4-氟苯甲酸酯;5、5 -DM-2 2 -bipy = 5, 5 ' -dimethyl-2 2 '关于环)。所有配合物均呈现一致的三斜结构。每个配合物的双核单元可以通过氢键相互作用连接起来。值得一提的是,尽管它们的复杂结构不同,但中心金属保持一致的配位数。对配合物1 ~ 3的荧光光谱进行了测量,揭示了相应离子的发光性质。利用密度泛函理论(DFT)对其发光机理进行了合理化论证。最后利用TG-DSC/FTIR/MS对配合物的详细分解模式进行了研究。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Five lanthanide complexes based on hydrogen bond interactions: fluorescence properties, thermal analysis, and DFT calculations

Five lanthanide complexes based on hydrogen bond interactions: fluorescence properties, thermal analysis, and DFT calculations
At room temperature, five novel complexes were synthesized with the following specific formulas: [Ln(4-FBA)3(5,5′-DM-2,2′-bipy)(H2O)]2, (Ln = Sm(1), Tb(2), Eu(3),Gd(4)); [Ln(4-FBA)3(5,5′-DM-2,2′-bipy)]2·6(H2O)·2(C2H6O)·2(5,5′-DM-2,2′-bipy), (Ln = Er(5); 4-FBA = 4-fluorobenzoate; 5,5′-DM-2,2′-bipy = 5,5′-dimethyl-2,2′-bipyridine). All of the complexes exhibit a consistent triclinic structure. The binuclear units of each complex can be connected by hydrogen bonding interactions. It is worth mentioning that, irrespective of the differences in their complex architectures, the central metal maintains a consistent coordination number. The measurement of the fluorescence spectra for complexes 1–3 was conducted, revealing the luminescent properties of the corresponding ions. The luminescence mechanism is confirmed by the rationalization of density functional theory (DFT). Finally, TG-DSC/FTIR/MS was used to study the detailed decomposition mode of the complexes.
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来源期刊
Journal of Solid State Chemistry
Journal of Solid State Chemistry 化学-无机化学与核化学
CiteScore
6.00
自引率
9.10%
发文量
848
审稿时长
25 days
期刊介绍: Covering major developments in the field of solid state chemistry and related areas such as ceramics and amorphous materials, the Journal of Solid State Chemistry features studies of chemical, structural, thermodynamic, electronic, magnetic, and optical properties and processes in solids.
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