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Surface complexation modeling of coadsorption of antibiotic ciprofloxacin and Cu(II) and onto goethite surfaces

机译:抗生素环丙沙星和铜(II)与针铁矿表面共吸附的表面络合模型

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The coadsorption behavior of Cu(II) and ciprofloxacin (Cip), a zwitterionic fluoroquinolone (FQ) antibiotic, to goethite surfaces was characterized by means of batch adsorption experiments, attenuated total reflectance Fourier transform infrared (ATR-FTIR) spectroscopy, and extended X-ray absorption fine structure (EXAFS) spectroscopy. The collective quantitative and spectroscopic results indicate that Cip was adsorbed onto goethite surfaces through a tridentate complex involving the bidentate inner-sphere coordination of the deprotonated carboxylate group and H-bonding through the adjacent carbonyl group on the quinoline ring. In contrast, in the presence of Cu(II), Cip adsorption is enhanced around pH 6. Spectroscopic results showed that a goethite-Cu-Cip ternary surface complex is formed through the bidentate coordination of Cu(II) with the oxygen from the deprotonated carboxylate group and the adjacent carbonyl oxygen. A charge distribution (CD) surface complexation model constrained by spectroscopic observations was developed to describe macroscopic adsorption trends. The model well described the adsorption of Cip and Cu(II) under various conditions with one set of parameters. These findings will help quantitatively predict the adsorption behavior of Cip and Cu(II) onto ferric oxides. (C) 2015 Elsevier B.V. All rights reserved.
机译:通过分批吸附实验,衰减全反射傅里叶变换红外光谱(ATR-FTIR)和扩展X表征了铜(II)和两性离子氟喹诺酮(FQ)抗生素环丙沙星(Cip)对针铁矿表面的共吸附行为。射线吸收精细结构(EXAFS)光谱。集体的定量和光谱结果表明,Cip通过三齿复合物吸附在针铁矿表面上,该复合物涉及去质子化羧酸酯基的二齿内球配位并通过喹啉环上的相邻羰基进行氢键结合。相反,在Cu(II)的存在下,pH 6时Cip吸附增强。光谱结果表明,通过Cu(II)与去质子化的氧的双齿配位形成针铁矿-Cu-Cip三元表面复合物。羧酸根基团和相邻的羰基氧。建立了受光谱观察约束的电荷分布(CD)表面络合模型,以描述宏观吸附趋势。该模型用一组参数很好地描述了在各种条件下Cip和Cu(II)的吸附。这些发现将有助于定量预测Cip和Cu(II)在三氧化二铁上的吸附行为。 (C)2015 Elsevier B.V.保留所有权利。

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