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基于 1,10-菲啰啉的 Cu(II) 双香豆素配合物的合成、X 射线衍射研究、热行为和生物评价。

Dicoumarol complexes of Cu(II) based on 1,10-phenanthroline: synthesis, X-ray diffraction studies, thermal behavior and biological evaluation.

机构信息

V.P. & R.P.T.P. Science College, Sardar Patel University, Vallabh Vidyanagar 388 120, Gujarat, India.

出版信息

Spectrochim Acta A Mol Biomol Spectrosc. 2013 May;108:319-28. doi: 10.1016/j.saa.2012.09.096. Epub 2012 Oct 12.

Abstract

A series of Cu(II) complexes containing dicoumarol derivatives and 1, 10-phenanthroline have been synthesized. Structural and spectroscopic properties of ligands were studied on the basis of mass spectra, NMR ((1)H and (13)C) spectra, FT-IR spectrophotometry and elemental analysis, while physico-chemical, spectroscopic and thermal properties of mixed ligand complexes have been studied on the basis of infrared spectra, mass spectra, electronic spectra, powder X-ray diffraction, elemental analysis and thermogravimetric analysis. X-ray diffraction study suggested the suitable octahedral geometry for hexa-coordinated state. The kinetic parameters such as order of reaction (n), energy of activation (Ea), entropy (S()), pre-exponential factor (A), enthalpy (H()) and Gibbs free energy (G(*)) have been calculated using Freeman-Carroll method. Ferric-reducing antioxidant power (FRAP) of all complexes were measured. All the compounds were screened for their antibacterial activity against Escherichia coli, Pseudomonas aeruginosa, Streptococcus pyogenes and Bacillus subtilis, while antifungal activity against Candida albicans and Aspergillus niger have been carried out. Also compounds against Mycobacterium tuberculosis shows clear enhancement in the anti-tubercular activity upon copper complexation.

摘要

已经合成了一系列含有双香豆素衍生物和 1,10-菲咯啉的 Cu(II)配合物。基于质谱、NMR((1)H 和 (13)C)谱、FT-IR 分光光度法和元素分析研究了配体的结构和光谱性质,而混合配体配合物的物理化学、光谱和热性质则基于红外光谱、质谱、电子光谱、粉末 X 射线衍射、元素分析和热重分析进行了研究。X 射线衍射研究表明,六配位状态适合采用八面体几何形状。使用 Freeman-Carroll 方法计算了反应级数 (n)、活化能 (Ea)、熵 (S())、指数前因子 (A)、焓 (H()) 和吉布斯自由能 (G(*))等动力学参数。测量了所有配合物的铁还原抗氧化能力 (FRAP)。所有化合物均针对大肠杆菌、铜绿假单胞菌、化脓性链球菌和枯草芽孢杆菌进行了抗菌活性筛选,同时针对白色念珠菌和黑曲霉进行了抗真菌活性筛选。此外,化合物对结核分枝杆菌的抗结核活性在铜络合后明显增强。

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