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SYNTHESIS,STRUCTURE,PROPERTIES AND QUANTUM-CHEMICAL STUDIES OF CUBANE-LIKE CLUSTER COMPOUND WITH ALL-CHELATING LIGANDS [(C_2H_5)_4N]_2{Fe_4S_4[S_2CN(C_2H_5)_2]_4}
作者姓名:徐吉庆  千吉松  魏诠  郭纯孝  杨光弟
作者单位:Department of Chemistry,Jilin University,Changchun,Department of Chemistry,Jilin University,Changchun,Department of Chemistry,Jilin University,Changchun,Department of Chemistry,Jilin University,Changchun,Institute of Theoretical Chemistry,Jilin University,Changchun
基金项目:the National Natural Science Foundation of China.
摘    要:Under anaerobic and water-free condition and pure dinitrogen atmosphere, the title com-pound has been synthesized from FeCl_2, (NH_4)_2WS_4, NaS_2CN(C_2H_5)_2 and (C_2H_5)_4NBr. Thecompound crystallizes in the monoclinic space group Cc with cell constants a = 22. 125(6)A,b = 11.313(3) A, c = 25.053(8) A, β= 118.05(2)°, V = 5534.2A~3, Z = 4. It contains cubane-like Fe_4S_4 core. Each Fe atom in the compound is coordinated by a disulfide-chelate ligand.The determination results of the Mossbauer spectrum arid XPS, and quantum-chemical cal-culation all show that the compound contains two kinds of Fe in different valence states butin an equal amount. The scheme of the formation reaction for the compound is given. Thespectra of IR and UV-vis, and redox properties for the compound are reported.


SYNTHESIS, STRUCTURE,PROPERTIES AND QUANTUM-CHEMICAL STUDIES OF CUBANE-LIKE CLUSTER COMPOUND WITH ALL-CHELATING LIGANDS [(C_2H_5)_4N]_2{Fe_4S_4[S_2CN(C_2H_5)_2]_4}
XU JI-QING,QIAN JI-SONG,WEI QUAN,GUO CHUN-XIAO,YANG GUANG-DI.SYNTHESIS,STRUCTURE,PROPERTIES AND QUANTUM-CHEMICAL STUDIES OF CUBANE-LIKE CLUSTER COMPOUND WITH ALL-CHELATING LIGANDS [(C_2H_5)_4N]_2{Fe_4S_4[S_2CN(C_2H_5)_2]_4}[J].Science in China(Chemistry),1989(8).
Authors:XU JI-QING  QIAN JI-SONG  WEI QUAN  GUO CHUN-XIAO  YANG GUANG-DI
Institution:XU JI-QING,QIAN JI-SONG,WEI QUAN,GUO CHUN-XIAO,YANG GUANG-DI Department of Chemistry,Jilin University,Changchun Institute of Theoretical Chemistry,Jilin University,Changchun
Abstract:
Keywords:synthesis  structure  Fe-S cluster  quantum-chemical study  
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