[(η⁵-C₅H₃)₂(SiMe₂)₂]Fe₂(CO)₄I₂ | 1601426-34-9

• 英文名称: [(η⁵-C₅H₃)₂(SiMe₂)₂]Fe₂(CO)₄I₂
• CAS: 1601426-34-9
• 化学式: C₁₈H₁₈Fe₂I₂O₄Si₂
• 分子量: 720.013
• InChiKey: XQIAEVVQSQTAHB-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  [(η5-C5H3)2(SiMe2)2]Fe2(CO)2(μ-CO)2 、 碘 以 苯 为溶剂， 反应 0.5h， 以51%的产率得到[(η⁵-C₅H₃)₂(SiMe₂)₂]Fe₂(CO)₄I₂
  参考文献：
  名称：

  Structures and reactivity of doubly-bridged dicyclopentadienyl dinuclear iron complexes

  摘要：

  The molecular structure of the doubly-bridged bis(cyclopentadienyl) diiron complex [(eta(5)-C5H3)(2) (SiMe2)(2)]Fe-2(CO)(2)(mu-CO)(2) (1b) was determined, and compared with that of the other analogue [(eta(5)-C5H3)(2)(CMe2)(SiMe2)]Fe-2(CO)(4) (1a). The former involves two bridging and two terminal carbonyls, and a normal Fe-Fe bond distance, while the latter contains all-terminal carbonyls and a longer than normal Fe-Fe bond distance. The possible reason for different coordination modes is discussed. Complexes (1a-b) react with I-2 to give the corresponding diiodo products [(eta(5)-C5H3)(2)(EMe2)(SiMe2)]Fe-2(CO)(4)I-2 (E = C, 2a; E = Si, 2b) and with phenylacetylene to give the bridging mu-C=CHPh products [(eta(5)-C5H3)(2) (EMe2)(SiMe2)]Fe-2(CO)(2)(mu-CO)(mu-C=CHPh) (3a-b). Reaction of 1a with Na/Hg, then with MeI yields the unexpected desilylated product [(eta(5)-C5H4)(2)(CMe2)][Fe(CO)(2)Me](2) (5a). Reaction of 1b with LiBHEt3 affords the bridging methylene product [(eta(5)-C5H3)(2)(SiMe2)(2)]Fe-2(CO)(2)(mu-CO)(mu-CH2) (6b). The molecular structures of 2a and 3b were also determined by X-ray diffraction. (C) 2014 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2014.01.027