(η(5)-C5H5)Fe(CO)2Zr(O-t-Bu)(η(5)-C5H5)2 | 84303-42-4

• 英文名称: (η(5)-C5H5)Fe(CO)2Zr(O-t-Bu)(η(5)-C5H5)2
• CAS: 84303-42-4
• 化学式: C₂₁H₂₄FeO₃Zr
• 分子量: 471.491
• InChiKey: ANHAIZHSIUKXJP-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：
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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：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  (η(5)-C5H5)Fe(CO)2Zr(O-t-Bu)(η(5)-C5H5)2 、 二氧化碳 以 四氢呋喃 为溶剂， 以60%的产率得到(η(5)-C5H5)Fe(CO)2(CO2)Zr(O-t-Bu)(η(5)-C5H5)2
  参考文献：
  名称：

  Characterization of the μ-(η1-C: η2-S,S′) dithiocarboxylate complexes Cp(CO)2Fe–CS2–Zr(X)Cp2 (X=Cl, OCMe3); CS2 insertion into the FeZr bond of the heterobimetallic complex Cp(CO)2Fe–Zr(OCMe3)Cp2

  摘要：

  Treatment of the carbon disulfide adducts FpCS(2)K and Fp'CS2K [Fp' = (eta(5)-C5H4CH3)Fe(CO)(2)] with Cp2ZrCl2 affords the mu-(eta(1)-C: eta(2)-S,S') dithiocarboxylate complexes FpCS(2)ZrClCp(2) (1) and Fp'CS2ZrClCp2 (2). Both stable products were fully characterized. Metathesis between FpCS(2)K and Cp2ZrCl(OCMe3) provided FpCS(2)Zr(OCMe3)Cp-2 (3), which was not obtained analytically pure. This product was characterized by comparison of its IR and H-1-, C-13{H-1}-NMR spectral data with that for 1 and 2. The iron-zirconium complex FpZr(OCMe3)Cp-2 (4) was transformed by one equivalent of CS2 to 3 (75% spectroscopic yield), a reaction that did not occur for FpZrClCp(2). An insertion pathway is discussed for incorporating the CS2 into the Fe-Zr bond of FpZr(OCMe3)Cp-2. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(98)00752-9
• 作为产物：
  描述：

  potassium cyclopentadienyldicarbonyliron(0) 、 (η(5)-C5H5)2ZrCl(O-t-Bu) 生成 (η(5)-C5H5)Fe(CO)2Zr(O-t-Bu)(η(5)-C5H5)2
  参考文献：
  名称：

  Metal-metal-bonded zirconium-ruthenium and zirconium-iron complexes

  摘要：

  DOI：

  10.1021/ja00341a081

文献信息

• (C5H5)2Zr[Ru(CO)2C5H5]2. A metal-metal bonded zirconium-diruthenium complex
  作者：Charles P. Casey、Richard F. Jordan、Arnold L. Rheingold

  DOI：10.1021/om00081a036

  日期：1984.3