Synthesis, Structure and Quantum Chemistry of Scorpionates Oxovanadium Compleses: Tp*VO(OOCHCCHCOOCH3)(pz*H) and Tp*VO(DMSO)(NCS)
文献类型：期刊论文
| 作者 | Wei Dong-Ming1; Dong Bin2; Li Zhang-Peng1; Bai Feng-Ying1; Cao Yun-Zhu1; Xing Yong-Heng1; Pu Zhi-Feng3; Ge Mao-Fa3 |
| 刊名 | CHINESE JOURNAL OF INORGANIC CHEMISTRY
 |
| 出版日期 | 2011-05-01 |
| 卷号 | 27期号:5页码:891-897 |
| 关键词 | Oxovanadium Complexes Poly(Pyrazolyl)Borate Crystal Structure Quantum Chemistry |
| ISSN号 | 1001-4861 |
| 英文摘要 | Two new half-sandwich monomeric complexes of oxovanadium (IV), Tp*VO(OOCHCCHCOOCH3)(pz*H) (1) and Tp*VO(DMSO)(NCS) (2) (Tp*.hydrotris(3,5-dimethylpyrazolyl)borate, pz*H=3,5-dimethylpyrazole) have been synthesized from the reaction of VOSO4 center dot nH(2)O with respective ligands. The complexes were characterized by element analysis, IR spectra and single crystal X-ray diffraction. The electronic structure and the bonding characters of the two complexes were analyzed with ab initio calculations. The calculations results showed that the structural stability of complexes 1 and 2 are close. The atomic net charge distribution in the molecular system indicates obvious covalent interaction between the coordinated atoms (N, O) and vanadium. The results are consistent with the structural analysis of complexes. CCDC: 784501, 1; 784502, 2. |
| 语种 | 英语 |
| WOS记录号 | WOS:000290468000015 |
| 出版者 | CHINESE CHEMICAL SOC |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/73359]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Xing Yong-Heng |
| 作者单位 | 1.Liaoning Normal Univ, Coll Chem & Chem Engn, Dalian 116029, Liangning, Peoples R China 2.Dalian Nationalities Univ, Sch Sci, Dalian 116600, Liangning, Peoples R China 3.Chinese Acad Sci, Inst Chem, Beijing 100080, Peoples R China |
| 推荐引用方式 GB/T 7714 | Wei Dong-Ming,Dong Bin,Li Zhang-Peng,et al. Synthesis, Structure and Quantum Chemistry of Scorpionates Oxovanadium Compleses: Tp*VO(OOCHCCHCOOCH3)(pz*H) and Tp*VO(DMSO)(NCS)[J]. CHINESE JOURNAL OF INORGANIC CHEMISTRY,2011,27(5):891-897. |
| APA | Wei Dong-Ming.,Dong Bin.,Li Zhang-Peng.,Bai Feng-Ying.,Cao Yun-Zhu.,...&Ge Mao-Fa.(2011).Synthesis, Structure and Quantum Chemistry of Scorpionates Oxovanadium Compleses: Tp*VO(OOCHCCHCOOCH3)(pz*H) and Tp*VO(DMSO)(NCS).CHINESE JOURNAL OF INORGANIC CHEMISTRY,27(5),891-897. |
| MLA | Wei Dong-Ming,et al."Synthesis, Structure and Quantum Chemistry of Scorpionates Oxovanadium Compleses: Tp*VO(OOCHCCHCOOCH3)(pz*H) and Tp*VO(DMSO)(NCS)".CHINESE JOURNAL OF INORGANIC CHEMISTRY 27.5(2011):891-897. |
入库方式： OAI收割
来源：化学研究所
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