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A binuclear isocyanide azadithiolatoiron complex relevant to the active site of Fe-only hydrogenases: Synthesis, structure and electrochemical properties
Hou, Jun; Peng, Xiaojun; Liu, Jifeng; Gao, Yunling; Zhao, Xing; Gao, Shang; Han, Keli
关键词Bioinorganic Chemistry Density Functional Calculations Hydrogenases Iron Isocyanide Ligands
刊名EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
2006-11-20
DOI10.1002/ejic.200600452
22页:4679-4686
收录类别SCI
文章类型Article
WOS标题词Science & Technology ; Physical Sciences
类目[WOS]Chemistry, Inorganic & Nuclear
研究领域[WOS]Chemistry
关键词[WOS]EFFECTIVE CORE POTENTIALS ; IRON HYDROGENASE ; DESULFOVIBRIO-DESULFURICANS ; MOLECULAR CALCULATIONS ; CLOSTRIDIUM-PASTEURIANUM ; FUNCTIONAL MODELS ; DIIRON SUBSITE ; CHEMISTRY ; EVOLUTION ; COORDINATION
英文摘要An aromatic isocynide-substituted diiron complex 5 has been synthesized as amimic for the active site of Fe-only hydrogenases. Its structure has been fully characterised by X-ray crystallography. The 4-iodophenylisocyanide ligands in 5 are in the basal positions and are nearly parallel to each other, with pi-pi stacking interactions. Four isomeric geometries of complex 5 have been optimized by DFT calculations, and the electrochemical properties of 5 have been investigated by cyclic voltammetry in the absence and presence of p-toluenesulfonic acid (HOTs). Analysis of the cyclic voltammetric curve indicates that the reduction event at about -1.43 V is electrocatalytically active to proton reduction. This potential is more positive than that of any functionalized propanedithiolatidiiron complex. (c) Woley-VCH Verlag GmbH & Co. KGaA.
语种英语
WOS记录号WOS:000242551900027
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被引频次:33[WOS]   [WOS记录]     [WOS相关记录]
文献类型期刊论文
条目标识符http://cas-ir.dicp.ac.cn/handle/321008/140088
专题中国科学院大连化学物理研究所
作者单位1.Dalian Univ Technol, State Key Lab Fine Chem, Dalian 116012, Peoples R China
2.Chinese Acad Sci, Dalian Inst Chem Phys, State Key Lab Mol React Dynam, Dalian 116022, Peoples R China
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Hou, Jun,Peng, Xiaojun,Liu, Jifeng,et al. A binuclear isocyanide azadithiolatoiron complex relevant to the active site of Fe-only hydrogenases: Synthesis, structure and electrochemical properties[J]. EUROPEAN JOURNAL OF INORGANIC CHEMISTRY,2006(22):4679-4686.
APA Hou, Jun.,Peng, Xiaojun.,Liu, Jifeng.,Gao, Yunling.,Zhao, Xing.,...&Han, Keli.(2006).A binuclear isocyanide azadithiolatoiron complex relevant to the active site of Fe-only hydrogenases: Synthesis, structure and electrochemical properties.EUROPEAN JOURNAL OF INORGANIC CHEMISTRY(22),4679-4686.
MLA Hou, Jun,et al."A binuclear isocyanide azadithiolatoiron complex relevant to the active site of Fe-only hydrogenases: Synthesis, structure and electrochemical properties".EUROPEAN JOURNAL OF INORGANIC CHEMISTRY .22(2006):4679-4686.
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