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合成、晶体结构及两种新型 Pr 羧酸配位聚合物的二维相关红外光谱研究。

Synthesis, crystal structure, and two-dimension correlation infrared spectroscopy on two novel Pr carboxylic acid coordination polymers.

机构信息

College of Qian'an, North China University of Science and Technology, Qian'an, Hebei 064400, PR China.

Department of Chemistry, Fuzhou University, Fuzhou, Fujian 350002, PR China.

出版信息

Spectrochim Acta A Mol Biomol Spectrosc. 2019 Apr 15;213:430-437. doi: 10.1016/j.saa.2019.01.055. Epub 2019 Jan 17.

Abstract

Two new coordination polymers [Pr(PCPA)(HO)]1 and [Pr(PCPA)(HO)]·nHO 2(PCPA = p-chlorophenoxyacetic acid) have been synthesized under similar conditions by the hydrothermal method and characterized by single-crystal X-ray diffraction, elemental analyses, powder X-ray diffraction (PXRD) analysis, IR spectroscopy, two-dimensional correlation infrared spectroscopy(2D-IR COS) and ultraviolet-visible diffuse reflection integral spectroscopy (UV-Vis DRIS). 1 displays a 1D infinite chain, which is further linked by O/CH⋯O hydrogen bonds to form a 3D supra-molecular architecture. 2 shows a 2D layer structure, which is extended by CH⋯Cl hydrogen bonds generating a 3D network. Noteworthy, we also studied 2D-IR COS under the thermal perturbation to contribute to the development of theory. The 2D-IR correlation spectroscopy analysis is consistent with the analysis of structure and it is superior to 1D IR spectroscopy especially in the coordinated carboxyl group.

摘要

两种新的配位聚合物[Pr(PCPA)(HO)]1 和 [Pr(PCPA)(HO)]·nHO(PCPA=对氯苯氧乙酸)在相似条件下通过水热法合成,并通过单晶 X 射线衍射、元素分析、粉末 X 射线衍射(PXRD)分析、红外光谱、二维相关红外光谱(2D-IR COS)和紫外-可见漫反射积分光谱(UV-Vis DRIS)进行了表征。1 显示出一维无限链,通过 O/CH⋯O 氢键进一步连接形成三维超分子结构。2 显示出二维层状结构,通过 CH⋯Cl 氢键扩展生成三维网络。值得注意的是,我们还研究了热扰动下的 2D-IR COS,为理论的发展做出了贡献。二维相关红外光谱分析与结构分析一致,并且优于一维红外光谱,特别是在配位羧基中。

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