生物活性有机硅(IV)配合物的合成及光谱、抗菌、分子研究

Har Lal Singh, J.B. Singh, Sunita Bhanuka
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引用次数: 10

摘要

一系列新的有机硅(IV)配合物的通式为R3SiL和RSiLOEt,具有席夫碱(R = Me和Ph)。希夫碱(LH)分别由(2-羟基苯基)(吡咯烷-1-基)甲烷与氨基脲、硫代氨基脲和苯基硫代氨基脲缩合而得。通过元素分析、摩尔电导和光谱(UV、IR、1H、13C和29Si NMR)研究对化合物进行了表征。这些研究表明,配体通过酚氧、亚甲基氮和硫代硫与硅原子以三叉叉的方式配位。进一步应用实验光谱学技术,利用B3LYP/6.31+g(d,p)密度泛函理论计算的理论数据也被用于结构测定。所得到的配合物被认为具有三角双锥体和畸变八面体几何形状。很少有代表性的希夫碱及其硅配合物对革兰氏阳性和革兰氏阴性菌的体外抗菌活性被筛选出来。测定所选化合物的最低抑菌浓度(MIC)。筛选结果表明,有机硅(IV)配合物比游离配体具有更好的抗菌活性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Synthesis and spectral, antibacterial, molecular studies of biologically active organosilicon(IV) complexes

A series of new organosilicon(IV) complexes have general formulae R3SiL and RSiLOEt with Schiff bases (R = Me and Ph). The Schiff bases (LH) have been derived from the condensation of (2-hydroxyphenyl)(pyrrolidin-1-yl)methanone with semicarbazide, thiosemicarbazide, and phenylthiosemicarbazide, respectively. The compounds have been characterized by the elemental analysis, molar conductance, and spectral (UV, IR, 1H, 13C, and 29Si NMR) studies. These studies showed that the ligands coordinate with the silicon atom in a tridentate manner through phenolic oxygen, azomethine nitrogen and thiolic sulfur. Further applying experimental spectroscopic techniques, theoretical data calculated using density functional theory by B3LYP/6.31+g(d,p) has also been used for structural determination. The resulting complexes have been proposed to have trigonal bipyramidal and distorted octahedral geometries. Few representative Schiff base and their silicon complexes have been screened for their in vitro antibacterial activity against Gram-positive and Gram-negative bacteria. The minimum inhibitory concentration (MIC) of selected compounds was determined. The screening results show that organosilicon(IV) complexes have better antibacterial activity than the free ligands.

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