Structural and Photophysical Properties of a Cd(II) Coordination Polymer Based on Mixed Aromatic Ligands: A Combined Experimental and Theoretical Study
文献类型：期刊论文
| 作者 | Zhang, Hang1,3; Zhou, Can-Hua2; Liu, Dong3; Li, Guang-Yue3 |
| 刊名 | JOURNAL OF INORGANIC AND ORGANOMETALLIC POLYMERS AND MATERIALS
 |
| 出版日期 | 2017-07-01 |
| 卷号 | 27页码:923-933 |
| 关键词 | Coordination Polymer Ligand-to-ligand Charge Transfer Density Functional Theory Frontier Molecular Orbital Fluorescence |
| DOI | 10.1007/s10904-017-0537-5 |
| 英文摘要 | A novel one-dimensional Cd(II) coordination polymer (CP) based on mixed aromatic ligands was synthesized and characterized by X-ray diffraction, thermogravimetric analysis and spectroscopic analyses. Fingerprint plots in Hirshfeld surface analysis illustrate that the one-dimensional crystal structure of the CP is stabilized by C-H center dot center dot center dot O, pi center dot center dot center dot pi, C-H center dot center dot center dot pi, and H center dot center dot center dot H intermolecular interactions. The structural and photophysical properties of the CP were then investigated by time-dependent density functional theory methods, and computational results well reproduced the experimental data. The combined investigations found a ligand-to-ligand charge transfer character during the electrons relax from the first singlet excited(1) state of the CP. The weak fluorescence of CP could be resulted from the energy interlacing of the frontier molecular orbitals (FMOs) of aromatic ligands and the fulfilled d (10) configuration of Cd(II). Herein, this CP exhibits as a potential tunable luminescent sensor by adjusting the energy levels of the FMOs of aromatic ligands. |
| 语种 | 英语 |
| WOS记录号 | WOS:000403706000009 |
| 源URL | [http://cas-ir.dicp.ac.cn/handle/321008/152126]  |
| 专题 | 大连化学物理研究所_中国科学院大连化学物理研究所 |
| 作者单位 | 1.North China Univ Sci & Technol, Modern Technol & Educ Ctr, Tangshan 063009, Peoples R China 2.Chinese Acad Sci, Dalian Inst Chem Phys, Key Lab Chem Lasers, Dalian 116023, Peoples R China 3.North China Univ Sci & Technol, Coll Chem Engn, Tangshan 063009, Peoples R China |
| 推荐引用方式 GB/T 7714 | Zhang, Hang,Zhou, Can-Hua,Liu, Dong,et al. Structural and Photophysical Properties of a Cd(II) Coordination Polymer Based on Mixed Aromatic Ligands: A Combined Experimental and Theoretical Study[J]. JOURNAL OF INORGANIC AND ORGANOMETALLIC POLYMERS AND MATERIALS,2017,27:923-933. |
| APA | Zhang, Hang,Zhou, Can-Hua,Liu, Dong,&Li, Guang-Yue.(2017).Structural and Photophysical Properties of a Cd(II) Coordination Polymer Based on Mixed Aromatic Ligands: A Combined Experimental and Theoretical Study.JOURNAL OF INORGANIC AND ORGANOMETALLIC POLYMERS AND MATERIALS,27,923-933. |
| MLA | Zhang, Hang,et al."Structural and Photophysical Properties of a Cd(II) Coordination Polymer Based on Mixed Aromatic Ligands: A Combined Experimental and Theoretical Study".JOURNAL OF INORGANIC AND ORGANOMETALLIC POLYMERS AND MATERIALS 27(2017):923-933. |
入库方式： OAI收割
来源：大连化学物理研究所
浏览0
下载0
收藏0
其他版本
除非特别说明，本系统中所有内容都受版权保护，并保留所有权利。