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含Fe3S3簇核的两个异构体化合物的合成和结构研究
引用本文:刘平,黄梁仁,王玲玲,康北笙,卢嘉锡.含Fe3S3簇核的两个异构体化合物的合成和结构研究[J].化学学报,1988,46(10):972-977.
作者姓名:刘平  黄梁仁  王玲玲  康北笙  卢嘉锡
作者单位:中国科学院福建物质结构研究所
摘    要:用氯化亚铁、苯硫酚钠及溴化四乙基铵在乙腈溶液中, 经一步反应, 得到两个同分异构的化合物α-Et4N]3Fe3(PhS)3Cl3Br3]1和β-Et4N]3Fe3(PhS)3Cl3Br3]2. X射线晶体结构测定表明, 1和2的阴离子骨架为3Fe、3S交叉排列的六元环, 前者为扭船型,后者为椅型. 1属单斜晶系, 空间群C2/c, 晶胞参数: a=24.569(4), b=13.504(2),c=18.348(3)埃, β=110.78(1)°. Z=4, R=0.070. 2属三方晶系, 空间群P3cl, 晶胞参数: a=b=13.720(3), c=35.748(5)埃, Z=4, R=0.059. 讨论了反应和结构特点.

关 键 词:分子结构  铁络合物  苯硫酚P  固氮酶  簇状化合物  异构体  过渡金属络合物  硫络合物  

Investigation on synthesis and structure of two isomeric compounds containing a Fe3S3 cluster centre
LIU PING,HUANG LIANGREN,WANG LINGLING,KANG BEISHENG,LU JIAXI.Investigation on synthesis and structure of two isomeric compounds containing a Fe3S3 cluster centre[J].Acta Chimica Sinica,1988,46(10):972-977.
Authors:LIU PING  HUANG LIANGREN  WANG LINGLING  KANG BEISHENG  LU JIAXI
Abstract:Two conformers of Et4N]3Fe3(PhS)3Cl3Br3] were prepared through 1 step reaction of FeCl2 with NaSPh and Et4NBr in MeCN. The skeletons of the anions are 6-membered rings with alternative Fe and S arrangement, 1 existing in twist boat form and the other in a chair form. Crystals are monoclinic, space group C2/c, Z = 4, R = 0.070, and trigonal, space group P3c1, Z = 4, R = 0.059, resp. The characteristics of the reaction and structures are discussed.
Keywords:MOLECULAR STRUCTURE  IRON COMPLEX  BENZENETHIOL P  NITROGENASE  CLUSTER COMPOUND  ISOMER  TRANSITION METAL COMPLEX  SULFIDE COMPLEX
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