Fe(η(5)-C5H4-(2-Me-1,2-closo-C2B10H10))2 | 11077-79-5

• 英文名称: Fe(η(5)-C5H4-(2-Me-1,2-closo-C2B10H10))2
• CAS: 11077-79-5
• 化学式: C₁₆H₃₄B₂₀Fe
• 分子量: 498.513
• InChiKey: STZVBXZBSXNXPD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  Fe(η(5)-C5H4-(2-Me-1,2-closo-C2B10H10))2 、 三甲胺盐酸盐 在 KOH 、 CO₂ 作用下， 以 乙醇 、 水 为溶剂， 以72%的产率得到(HNMe3)2[7,7'-Fe(η(5)-C5H4-7,8-nido-C2B9H10)2]
  参考文献：
  名称：

  Ferrocenyl substituted carboranes: synthesis and characterisation

  摘要：

  The reaction between ethynyl ferrocene and decaborane affords the new ferrocenyl substituted carborane 1-{Fc}-1,2-closo-C2B10H11 1 [Fc = (eta(5)-C5H4)Fe(eta(5)-C5H5)]. Deboronation of 1 gives K[7-{Fc}-7,8-nido-C2B9H11] 2, and subsequent metallation, using the {Ru(p-cym)} fragment, affords the novel ferrocenyl substituted ruthenacarborane 1-{Fc}-3-(p-cym)-3,1,2-closo-RuC2B9H10 3 (p-cym = 1-Me-C4H4-4-Pr-i). Reaction between bis(methylethynyl)ferrocene and decaborane affords the bis carborane substituted ferrocene l,l'-{Fc'}-{2-Me-1,2-closo-C2B10H10}(2), 4 [Fc' = (eta(5)-C5H4)Fe(eta(5)-C5H4)]. Deboronation of 4 results in the formation [HNMe3](2)[7,7'-{Fc'}-{7-Me-7,8-nido-C2B9H10}(2)], 5, isolated as a syn and anti diastereoisomeric pair. Metallation of 5 affords the trimetallic ruthenacarborane 1,1-{Fc'}-{2-Me-3-(p-cym)-3,1,2-closo-RuC2B9H9}(2) 3, as a mixture of syn and anti diastereoisomers. All the new complexes have been fully characterised by multinuclear NMR and micro-analysis, and for compounds 1, 3, 4 and anti-6 by a single crystal X-ray study. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(97)00676-1
• 作为产物：
  描述：

  decaborane(14) 、 1,1'-bis(methylethynyl)ferrocene 在 N,N-dimethylaniline 作用下， 以 甲苯 为溶剂， 以50%的产率得到Fe(η(5)-C5H4-(2-Me-1,2-closo-C2B10H10))2
  参考文献：
  名称：

  Ferrocenyl substituted carboranes: synthesis and characterisation

  摘要：

  The reaction between ethynyl ferrocene and decaborane affords the new ferrocenyl substituted carborane 1-{Fc}-1,2-closo-C2B10H11 1 [Fc = (eta(5)-C5H4)Fe(eta(5)-C5H5)]. Deboronation of 1 gives K[7-{Fc}-7,8-nido-C2B9H11] 2, and subsequent metallation, using the {Ru(p-cym)} fragment, affords the novel ferrocenyl substituted ruthenacarborane 1-{Fc}-3-(p-cym)-3,1,2-closo-RuC2B9H10 3 (p-cym = 1-Me-C4H4-4-Pr-i). Reaction between bis(methylethynyl)ferrocene and decaborane affords the bis carborane substituted ferrocene l,l'-{Fc'}-{2-Me-1,2-closo-C2B10H10}(2), 4 [Fc' = (eta(5)-C5H4)Fe(eta(5)-C5H4)]. Deboronation of 4 results in the formation [HNMe3](2)[7,7'-{Fc'}-{7-Me-7,8-nido-C2B9H10}(2)], 5, isolated as a syn and anti diastereoisomeric pair. Metallation of 5 affords the trimetallic ruthenacarborane 1,1-{Fc'}-{2-Me-3-(p-cym)-3,1,2-closo-RuC2B9H9}(2) 3, as a mixture of syn and anti diastereoisomers. All the new complexes have been fully characterised by multinuclear NMR and micro-analysis, and for compounds 1, 3, 4 and anti-6 by a single crystal X-ray study. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(97)00676-1