新型铕(III)、铽(III)和钆(III)希夫碱配合物:合成、结构、光致发光、抗菌、抗氧化和分子对接研究

IF 2.4 3区 化学 Q2 CHEMISTRY, INORGANIC & NUCLEAR
Hatice Gamze Sogukomerogullari , Eyüp Başaran , Remziye Aysun Kepekçi , Burçin Türkmenoğlu , Ahmet Oral Sarıoğlu , Muhammet Köse
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引用次数: 0

摘要

使用由 (2,2′-(thiophene-2,5-diylbis(methaneylyl-idene))bis(azaneylyl-idene))diphenol 组成的希夫碱配体 (H2L) 合成了三种镧系 (III) 化合物,即 L-Eu、L-Tb 和 L-Gd。研究人员使用元素分析、光谱分析(红外光谱、质谱-紫外-可见光谱)和摩尔电导率对通式为 LnL(Cl)(H2O)-xH2O(其中 L 为配体)的配合物进行了研究。接着,研究了镧系配合物的光致发光特性。与稳定的自由基 DPPH 相比,对合成化合物的抗氧化活性进行了评估。评估了希夫碱金属配合物对酵母菌株以及一些革兰氏阳性和革兰氏阴性细菌的抗菌活性。此外,还进行了计算研究,以阐明抗菌和抗氧化作用的机制。在分子对接中,确定了 1LL9、6J2O、3JPU、2MBR 和 1HD2 晶体结构为目标,并计算了 H2L、L-Tb、L-Gd 和 L-Eu 化合物与这些目标的对接分值。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Novel europium(III), terbium(III), and gadolinium(III) Schiff base complexes: Synthesis, structural, photoluminescence, antimicrobial, antioxidant, and molecular docking studies

Novel europium(III), terbium(III), and gadolinium(III) Schiff base complexes: Synthesis, structural, photoluminescence, antimicrobial, antioxidant, and molecular docking studies
Three lanthanide (III) complexes, L-Eu, L-Tb, and L-Gd, were synthesized using a Schiff base ligand (H2L) composed of (2,2′-(thiophene-2,5-diylbis(methaneylyl-idene))bis(azaneylyl-idene))diphenol. Complexes with the generic formula LnL(Cl)(H2O)·xH2O, where L is the ligand, was studied using elemental analysis, spectrum analysis (IR, mass- UV–Vis), and molar conductivity. Next, the photoluminescence characteristics of the lanthanide complexes were investigated. An assessment was conducted to ascertain the antioxidant activity of the synthetic compounds compared with that of the stable free radical DPPH. The antibacterial activity of the Schiff base metal complexes was assessed against a strain of yeast as well as against a number of Gram-positive and Gram-negative bacteria. Computational studies were also performed to elucidate the mechanisms of the antimicrobial and antioxidant effects. In molecular docking, 1LL9, 6J2O, 3JPU, 2MBR, and 1HD2 crystal structures were determined as targets and the docking score values of H2L, L-Tb, L-Gd, and L-Eu compounds for these targets were calculated.
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来源期刊
Polyhedron
Polyhedron 化学-晶体学
CiteScore
4.90
自引率
7.70%
发文量
515
审稿时长
2 months
期刊介绍: Polyhedron publishes original, fundamental, experimental and theoretical work of the highest quality in all the major areas of inorganic chemistry. This includes synthetic chemistry, coordination chemistry, organometallic chemistry, bioinorganic chemistry, and solid-state and materials chemistry. Papers should be significant pieces of work, and all new compounds must be appropriately characterized. The inclusion of single-crystal X-ray structural data is strongly encouraged, but papers reporting only the X-ray structure determination of a single compound will usually not be considered. Papers on solid-state or materials chemistry will be expected to have a significant molecular chemistry component (such as the synthesis and characterization of the molecular precursors and/or a systematic study of the use of different precursors or reaction conditions) or demonstrate a cutting-edge application (for example inorganic materials for energy applications). Papers dealing only with stability constants are not considered.
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