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首页> 外文期刊>The journal of physical chemistry, B. Condensed matter, materials, surfaces, interfaces & biophysical >Surface-enhanced resonance Raman spectroscopic studies of the Cd(II) and Hg(II) complexes of 1-(2-pyridylazo)-2-naphthol adsorbed on silver sol
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Surface-enhanced resonance Raman spectroscopic studies of the Cd(II) and Hg(II) complexes of 1-(2-pyridylazo)-2-naphthol adsorbed on silver sol

机译:吸附在银溶胶上的1-(2-吡啶基偶氮)-2-萘酚的Cd(II)和Hg(II)配合物的表面增强共振拉曼光谱研究

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摘要

The resonance Raman (RR) and surface-enhanced resonance Raman (SERRS) spectra of M(PAN)2 complexes (M = Cd and Hg, PAN(-) = 1-(2-pyridylazo)-2-naphtholate) are reported and assigned, and the nature of the adsorbed species are determined. Vibrational assignments are supported by ab initio calculations at the B3-LYP/LanL2DZ level. There is clear evidence for chemisorption of these complexes on the silver surface, which gives rise to substantial alteration of the Raman spectrum. Comparison of the variation of Raman intensities with excitation wavelength for the RR and SERRS spectra indicates that there is a modification of electronic structure upon adsorption. Alterations in the Raman spectrum upon adsorption were successfully interpreted by ab initio calculations of the interaction of M(PAN)(2) complexes with surface silver atoms binding through the azo group alpha-nitrogen atoms.
机译:报道了M(PAN)2配合物(M = Cd和Hg,PAN(-)= 1-(2-吡啶基偶氮)-2-萘甲酸)的共振拉曼光谱(RR)和表面增强共振拉曼光谱(SERRS),并分配,并确定吸附物质的性质。从头算起在B3-LYP / LanL2DZ级别支持振动分配。有明确的证据表明这些络合物在银表面发生化学吸附,从而引起拉曼光谱的显着改变。比较RR和SERRS光谱的拉曼强度随激发波长的变化,表明吸附后电子结构发生了变化。通过从头计算M(PAN)(2)配合物与通过偶氮基团α-氮原子结合的表面银原子的相互作用,成功地解释了吸附后拉曼光谱的变化。

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