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一种基于超分子冠醚的一维氢键连接的DL-α-苯甘氨酸包合物的合成、结构及介电性质

The Synthesis, Structure, and Dielectric Properties of a One-Dimensional Hydrogen-Bonded DL-α-Phenylglycine Supramolecular Crown-Ether-Based Inclusion Compound.

作者信息

Liu Yang, Hu Hongzhi, Qi Huanhuan, Lv Meixia, Liu Zunqi

机构信息

Chemistry and Chemical Engineering College, Xinjiang Agricultural University, Urumqi 830052, China.

Xinjiang Sub-Center, National Engineering Research Center of Novel Equipment for Polymer Processing, Urumqi 830052, China.

出版信息

Molecules. 2023 Nov 14;28(22):7586. doi: 10.3390/molecules28227586.

Abstract

A novel hydrogen-bonded supramolecular crown-ether-based inclusion compound, [(DL-α-Phenylglycine)(18-crown-6)](CoCl), was obtained via evaporation in a methanolic solution at room temperature using DL-α-phenylglycine, 18-crown-6, cobalt chloride (CoCl), and hydrochloric acid. Its structure, thermal properties, and electrical properties were characterized via elemental analysis, single-crystal X-ray diffraction, variable-temperature infrared spectroscopy, thermogravimetric analysis, differential scanning calorimetry, and variable temperature-variable frequency dielectric constant testing. The compound was a monoclinic crystal system in the space group at low temperature (100 K) and room temperature (293 K). Analysis of the single crystal structure showed that [(CoCl)] presented an edge-sharing ditetrahedral structure in the disordered state, while the protonated DL-α-phenylglycine molecule in the disordered state and intramolecular hydroxyl group (-OH) underwent dynamic rocking, causing a significant stretching motion of the O-H···Cl-type one-dimensional hydrogen bond chain. This resulted in dielectric anomalies in the three axes of the crystal, thus showing significant dielectric anisotropy.

摘要

通过在室温下于甲醇溶液中蒸发,使用DL-α-苯甘氨酸、18-冠-6、氯化钴(CoCl)和盐酸,获得了一种新型的基于氢键的超分子冠醚包合物,即[(DL-α-苯甘氨酸)(18-冠-6)][(CoCl)]。通过元素分析、单晶X射线衍射、变温红外光谱、热重分析、差示扫描量热法和变温变频介电常数测试对其结构、热性能和电性能进行了表征。该化合物在低温(100 K)和室温(293 K)下属于单斜晶系,空间群为 。单晶结构分析表明,[(CoCl)]在无序状态下呈现边共享双四面体结构,而无序状态下的质子化DL-α-苯甘氨酸分子和分子内羟基(-OH)发生动态摇摆,导致O-H···Cl型一维氢键链出现显著的拉伸运动。这导致晶体的三个轴出现介电异常,从而表现出显著的介电各向异性。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/9f70/10673173/9612a5987817/molecules-28-07586-g001.jpg

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