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首页> 外文期刊>Journal of Molecular Liquids >Analysis of coordination states for Dy(II) and Dy(III) complexes in ionic liquids by Raman spectroscopy and DFT calculation
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Analysis of coordination states for Dy(II) and Dy(III) complexes in ionic liquids by Raman spectroscopy and DFT calculation

机译:用拉曼光谱和DFT计算分析离子液体中Dy(II)和Dy(III)配合物的配位态

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摘要

The coordination states of the divalent and trivalent dysprosium complexes in ionic liquid, triethyl-pentyl-phosphonium bis(trifluoromethylsulfonyl) amide [P-2225][TFSA] were investigated by Raman spectroscopy and DFT calculations. The concentration dependences of the deconvoluted Raman spectra were investigated for 0.23-0.45 mol kg(-1) of pure Dy(III) and the mixed sample of Dy(II)/Dy(III) = 1/3 at the molar ratio in [P-2225][TFSA]. According to the conventional analysis, the solvation number; n of Dy(II) and Dy(III) in [P-2225][TFSA] were determined to ben = 4.12 and 5.00, respectively.
机译:通过拉曼光谱和DFT计算研究了离子液体三乙基戊基-双(三氟甲基磺酰基)酰胺[P-2225] [TFSA]中二价和三价配合物的配位态。研究了去卷积拉曼光谱对浓度为0.23-0.45 mol kg(-1)的纯Dy(III)和Dy(II)/ Dy(III)混合样品的摩尔比为1/3的依赖关系。 P-2225] [TFSA]。根据常规分析,溶剂化数; [P-2225] [TFSA]中Dy(II)和Dy(III)的n分别确定为ben = 4.12和5.00。

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