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首页> 外文期刊>Spectrochimica acta, Part A. Molecular and biomolecular spectroscopy >Bivalent transition metal complexes of (E)-3-(2-benzylidenehydrazinyl)-3-oxo-N-(p-tolyl)propanamide: Spectroscopic, computational, biological activity studies
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Bivalent transition metal complexes of (E)-3-(2-benzylidenehydrazinyl)-3-oxo-N-(p-tolyl)propanamide: Spectroscopic, computational, biological activity studies

机译:(E)-3-(2-苄叉肼基)-3-氧代-N-(对甲苯基)丙酰胺的二价过渡金属配合物:光谱,计算,生物学活性研究

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摘要

Schiff base complexes of Co(II), Ni(II) and Cu(II) with (E)-3-(2-benzylidenehydrazinyl)-3-oxo-N-(p-tolyl)-propanamide (H(2)BHAH) containing N and O donor sites were synthesized. Both ligand and its metal complexes were characterized by elemental analysis, thermal analysis (TG and DTG), spectroscopy (H-1 NMR, IR, UV-visible, MS spectra), and physical measurements (magnetic susceptibility and molar conductance). The kinetic and thermodynamic parameters of the different decomposition steps of some complexes were calculated using the Coats-Redfern and Horowitz-Metzger methods. Also, the DFT studying was evaluated to confirm the geometry of the investigated compounds. Moreover, the association and formation constants of Ni(II) and Cu(II) ions in mixed solvent at 290.15 K were calculated by using electrical conductance. The antimicrobial activities of the ligand and its complexes were studied against gram positive bacteria Staphylococcus aureus, gram negative bacteria; Escherichia coli and pathogenic fungi; Candida albicans by using minimum inhibition concentrations method. The antioxidant (ABTS-derived free radical method) and cytotoxic (in vitro Ehrlich Ascites) activities of the isolated compounds were estimated. (c) 2015 Elsevier B.V. All rights reserved.
机译:Co(II),Ni(II)和Cu(II)与(E)-3-(2-苄叉肼基)-3-氧代-N-(对甲苯基)-丙酰胺的席夫碱配合物(H(2)BHAH合成了包含N和O供体位点的)。配体及其金属络合物均通过元素分析,热分析(TG和DTG),光谱学(H-1 NMR,IR,紫外可见光,MS光谱)和物理测量(磁化率和摩尔电导)表征。使用Coats-Redfern和Horowitz-Metzger方法计算了某些配合物不同分解步骤的动力学和热力学参数。同样,对DFT研究进行了评估,以确认所研究化合物的几何形状。此外,使用电导率计算了混合溶剂中Ni(II)和Cu(II)离子在290.15 K时的缔合常数和形成常数。研究了配体及其配合物对革兰氏阳性菌金黄色葡萄球菌,革兰氏阴性菌的抗菌活性。大肠杆菌和致病真菌;白色念珠菌采用最小抑菌浓度法。估计了分离出的化合物的抗氧化剂(ABTS衍生的自由基方法)和细胞毒性(体外艾氏腹水)活性。 (c)2015 Elsevier B.V.保留所有权利。

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