首页> 外文期刊>Inorganica Chimica Acta >Coordination behavior of sulfamethazine drug towards Ru(III) and Pt(II) ions: Synthesis, spectral, DFT, magnetic, electrochemical and biological activity studies
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Coordination behavior of sulfamethazine drug towards Ru(III) and Pt(II) ions: Synthesis, spectral, DFT, magnetic, electrochemical and biological activity studies

机译:磺胺二甲嘧啶药物对Ru(III)和Pt(II)离子的配位行为:合成,光谱,DFT,磁,电化学和生物活性研究

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摘要

Ru(III) and Pt(II) complexes of sulfamethazine drug have been synthesized as antibacterial agents, aiming to enhance the biological activity of sulfamethazine drug against resistance development of some organisms and to throw more light about the debatable coordination behavior of sulfamethazine, and their structures were elucidated by several experimental and theoretical tools. Sulfamethazine acts as a bidentate ligand through sulfonamidic (N15) and pyrimidic (N23) nitrogen atoms. AC magnetic susceptibility measurements of Ru ~(III) complex showed anti-ferromagnetic behavior in 80-212 K with a Néel temperature at 128 K. Electrochemical studies revealed that -NH _2 and -SO _2 groups remain intact in complex formation. Antibacterial activity and structural activity relationship (SAR) showed that activity decreases with complex formation due to increase the energy of lowest unoccupied molecular orbital (E LUMO), dipole moment, and charge on sulfonamidic nitrogen (N15) as a result of formation of covalent M-sulfonamidic bond, which in turn suppress the activity.
机译:已经合成了磺胺二甲嘧啶药物的Ru(III)和Pt(II)配合物作为抗菌剂,旨在增强磺胺二甲嘧啶药物对某些生物体抗药性的生物活性,并为磺胺二甲嘧啶的可争议的配位行为及其应用提供了更多信息几种实验和理论工具阐明了结构。磺胺二甲嘧啶通过磺酰胺(N15)和嘧啶(N23)氮原子充当双齿配体。 Ru〜(III)配合物的交流磁化率测量结果显示,在80-212 K且Néel温度为128 K时,其反铁磁行为。电化学研究表明,-NH _2和-SO _2基团在配合物形成中保持完整。抗菌活性和结构活性关系(SAR)表明,由于形成共价M的最低未占据分子轨道(E LUMO)的能量,偶极矩和磺酰胺氮(N15)的电荷增加,活性随复合物的形成而降低。 -磺酰胺键,从而抑制了活性。

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