| 一种新颖有机/无机杂化配位聚合物[(C7H18N)(Ag2I3)]n的合成、结构及量子化学计算(英) |
| |
| 引用本文： | 李浩宏,陈之荣,黄长沧,肖光参,李俊篯,张文选. 一种新颖有机/无机杂化配位聚合物[(C7H18N)(Ag2I3)]n的合成、结构及量子化学计算(英)[J]. 无机化学学报, 2005, 21(6): 933-937 |
| |
| 作者姓名： | 李浩宏 陈之荣 黄长沧 肖光参 李俊篯 张文选 |
| |
| 作者单位： | 1. 福州大学化学化工学院,福州,350002
2. 福州大学测试中心,福州,350002 |
| |
| 基金项目： | 福建省教育厅基金项目资助(No.JB04016,JB04017)，福州大学科研训练计划(No.SRTP,03100)资助。 |
| |
| 摘 要： | A one dimensional coordination polymer, [(C7H18N)(Ag2I3)]n((C7H18N)+=Methyltriethylammonium) has been successfully synthesized and characterized by X-ray single-crystal diffraction method. Structure analysis shows that the compound consists of organic cations(Methyltriethylammonium) and inorganic anion chains (Ag2I3)n-. The inorganic moiety consists of AgI4 tetrahedron, which shares the same edges with adjacent AgI4 tetrahedrons to form one-dimensional infinite double chains along a-axis. There exists weak interaction among Ag…Ag atoms in the crystal. Anion chains are surrounded by Methyltriethylammonium cations. Anion chains and cations are in combination with each other by static attracting forces in the crystal to form so-called organic-inorganic hybrid structure. According to the crystal structure data, quantum chemistry calculation with DFT on B3LYP level was used to reveal the electronic structure of title compound. CCDC: 254288.
|
| 关 键 词： | 有机/无机杂化； 模板合成； 碘化银； 量子化学计算 |
| 收稿时间： | 2004-11-08 |
| 修稿时间： | 2005-02-24 |
Novel Inorganic-Organic Hybrid Coordination Polymer [(C7H18N)(Ag2I3)]n: Synthesis, Crystallographic Structure and Quantum Chemistry Calculation |
| |
| LI Hao-Hong,CHEN Zhi-Rong,HUANG Chang-Cang,XIAO Guang-Can,LI Jun-Qian and ZHANG Wen-Xuan. Novel Inorganic-Organic Hybrid Coordination Polymer [(C7H18N)(Ag2I3)]n: Synthesis, Crystallographic Structure and Quantum Chemistry Calculation[J]. Chinese Journal of Inorganic Chemistry, 2005, 21(6): 933-937 |
| |
| Authors: | LI Hao-Hong CHEN Zhi-Rong HUANG Chang-Cang XIAO Guang-Can LI Jun-Qian ZHANG Wen-Xuan |
| |
| Affiliation: | College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350002,College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350002,College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350002,Center of Analysis and Measurement, Fuzhou University, Fuzhou 350002,College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350002 and College of Chemistry and Chemical Engineering, Fuzhou University, Fuzhou 350002 |
| |
| Abstract: | A one dimensional coordination polymer, [(C7H18N)(Ag2I3)]n((C7H18N)+=Methyltriethylammonium) has been successfully synthesized and characterized by X-ray single-crystal diffraction method. Structure analysis shows that the compound consists of organic cations(Methyltriethylammonium) and inorganic anion chains (Ag2I3)n-.The inorganic moiety consists of AgI4 tetrahedron, which shares the same edges with adjacent AgI4 tetrahedrons to the crystal. Anion chains are surrounded by Methyltriethylammonium cations. Anion chains and cations are in combination with each other by static attracting forces in the crystal to form so-called organic-inorganic hybrid structure. According to the crystal structure data, quantum chemistry calculation with DFT on B3LYP level was used to reveal the electronic structure of title compound. CCDC: 254288. |
| |
| Keywords: | organic-inorganic hybrid template synthesis silve(Ⅰ) iodide quantum chemistry calculation |
| 本文献已被 CNKI 万方数据 等数据库收录！ |
| 点击此处可从《无机化学学报》浏览原始摘要信息 |
|
点击此处可从《无机化学学报》下载全文 |
|
