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Synthesis and Structural Characterization of [(h^5-C_5Me_5)_2Mo_2Fe_2S_4Br_2]

Synthesis and Structural Characterization of [(η~5-C_5Me_5)_2Mo_2Fe_2S_4Br_2]
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摘要 The reactions of [(h5-C5Me5)Mo(StBu)3] with equimolar FeBr3 in THF afforded a neutral tetranuclear cluster [(h5-C5Me5)2Mo2Fe2S4Br2] 1. The structure of 1 was determined by single-crystal X-ray diffraction analysis. 1 crystallizes in the monoclinic space group P21/n (No. 14) with a = 9.691(2), b = 15.204(2), c = 18.850(2) ? b = 96.44(1), V = 2759.8(7) ?, Z = 4, Mr = 862.08, Dc = 2.075 g/cm3, F(000) = 1680, m (MoKa) = 51.31 cm-1 and T = 296.2 K. With the use of 3667 observed reflections (I > 3.0s(I)), the structure was refined to R = 0.041 and Rw = 0.051. 1 is composed of a distorted Mo2Fe2S4 cubane core with two Br atoms and two h5-C5Me5 groups coordinating at the Fe and Mo sites, respectively. The lengths of MoMo and FeFe bonds are 2.826 and 2.773 ? respectively the mean length of MoFe bond is 2.751 ?
出处 《Chinese Journal of Structural Chemistry》 SCIE CAS CSCD 北大核心 2002年第1期34-37,共4页 结构化学(英文)
基金 This work was supported by the Key Laboratory of Organic Chemistry of Jiangsu Province at Suzhou University.
关键词 SYNTHESIS crystal structure molybdenum cluster iron cluster 簇合物 合成 晶体结构 [(η^-C5Me5)2Mo2Fe2S4Br2]
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