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首页> 外文期刊>Journal of inorganic and organometallic polymers and materials >Exploration of Intermolecular Interaction of One Silver(I) Polymer with Bis(pyrazolyl)methane Derivative: Experimental Observations, Hirshfeld Surface Analyses and Fluorescent Properties
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Exploration of Intermolecular Interaction of One Silver(I) Polymer with Bis(pyrazolyl)methane Derivative: Experimental Observations, Hirshfeld Surface Analyses and Fluorescent Properties

机译:一种银(I)聚合物与双(吡唑基)甲烷衍生物的分子间相互作用的探索:实验观察,Hirshfeld表面分析和荧光性质

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摘要

In the superbasic medium DMSO-KOH, bis(3,3-diethoxycarbonyl-1-pyrazolyl)methane (L) was synthesized. Besides, the single crystal of L has been obtained. Meanwhile, one novel coordination polymers, [Ag(L)(NO3)] (n) (1) was successfully prepared. The single X-ray diffraction data reveal that L crystallized in the P-1 space group. Novel bis(pyrazolyl)methane derivative ligand, L acts as multidentate ligands to coordinate with Ag ion to form a six-membered boat conformation. And furthermore the nitrate groups bridge each Ag(I) to construct a zigzag chain. The fluorescent properties of the complex were examined in solution and compared with the ligand. In order to investigate the intermolecular interactions, we also studied Hirshfeld surface analysis of ligand and the complex. The Hirshfeld surface analysis reveals that the main intermolecular interactions are H center dot center dot center dot H and O center dot center dot center dot H/H center dot center dot center dot O interactions which comprise 23.9 and 33.8 % of the total Hirshfeld surface area.
机译:在超碱性介质DMSO-KOH中,合成了双(3,3-二乙氧基羰基-1-吡唑基)甲烷(L)。此外,已经获得了L的单晶。同时,成功制备了一种新型的配位聚合物[Ag(L)(NO3)](n)(1)。单一的X射线衍射数据表明L在P-1空间群中结晶。新型双(吡唑基)甲烷衍生物配体L充当多齿配体,与Ag离子配位形成六元舟状构象。而且,硝酸盐基团桥接每个Ag(I)以构建Z字形链。在溶液中检查复合物的荧光性质,并与配体进行比较。为了研究分子间的相互作用,我们还研究了配体和配合物的Hirshfeld表面分析。 Hirshfeld表面分析表明,主要的分子间相互作用是H中心点中心点中心点H和O中心点中心点中心点H / H中心点中心点中心点O相互作用构成了Hirshfeld总表面积的23.9%和33.8% 。

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