[(benzene)FeCp](tetrabromoaluminate)(benzene) | 945982-47-8

• 英文名称: [(benzene)FeCp](tetrabromoaluminate)(benzene)
• CAS: 945982-47-8
• 化学式: AlBr₄*C₆H₆*C₁₁H₁₁Fe
• 分子量: 623.767
• InChiKey: RGFRSVWGEMONLU-UHFFFAOYSA-J

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：

  (ferrocenyl)dibromoborane 、 三溴化铝 、 苯 以 苯 为溶剂， 生成 tris(cyclopentadienyl)aluminium(III) 、 [(benzene)FeCp](tetrabromoaluminate)(benzene)
  参考文献：
  名称：

  Difference in reactivity of triel halides EX3 towards ferrocene

  摘要：

  A facile route to the Fe2+ -arene complex [(C6H6)FeCp][AlBr4] is the reaction of ferrocene with AlBr3 in benzene. The structure of the Fe2+-arene complex [(C6H6)FeCp][AlBr4] center dot C6H6 was found to be isomorphous with those of [FeCp2][ECl4] center dot C6H6 (E = Al, Ga). The crystal structures of the [FeCp2][AlCl4] center dot C6H6 (E = Al, Ga) presented here show structural features which are different from those of solvent-free ferrocenium salts [FeCp2][ECl4] (E = Al, Ga, Fe). However, the cell parameters of solvent-free ferrocenium tetrafluoroborate [FeCp2][BF4] are also quite diff rent from those of solvent-free [FeCp2][ECl4] (E = Al, Ga, Fe). In contrast to the eclipsed conformation in solvent-free [FeCp2][ECl4] (E = Al, Ga, Fe) the cyclopentadiene rings in [FeCp2][BF4] and [FeCp2][ECl4] center dot C6H6 (E = Al, Ga) are in a staggered conformation. (c) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2007.03.049