Fe-bis(η⁵-2,4,6,8-tetramethyl-5-hydro-s-indacenide) | 1552295-92-7

• 英文名称: Fe-bis(η⁵-2,4,6,8-tetramethyl-5-hydro-s-indacenide)
• CAS: 1552295-92-7
• 化学式: C₃₂H₃₄Fe
• 分子量: 474.469
• InChiKey: NQZUGGNAOOXGKD-UHFFFAOYSA-N

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：

  1,5-dihydro-2,4,6,8-tetramethyl-s-indacene 、 iron(II) diacetylacetonate 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 4.0h， 以68%的产率得到Fe-bis(η⁵-2,4,6,8-tetramethyl-5-hydro-s-indacenide)
  参考文献：
  名称：

  New mono and bimetallic iron complexes derived from partially methylated s-indacene. Evidence of a trinuclear iron s-indacene complex

  摘要：

  The preparation and characterization of new mono- and multinuclear iron complexes derived from s-indacene partially alkylated has been achieved by the development of rational synthetic routes. The synthesis of the new multimetallic complexes are based on the employment of 1,5-dihydro-2,4,6, 8-tetramethyl-s-indacene (Ic'H-2) as ligand to obtain two monometallic complexes, namely, [Cp*-Fe-(eta(5)-2,4,6,8-tetramethyl-5-hydro-s-indacenide)] (1), and [Fe-bis(eta(5)-2,4,6,8-tetramethyl-5-hydro-s-indacenide)] (2) (Cp* = pentamethylcyclopentadiene), as well as, the new bimetallic [Cp*Fe-(mu:eta(5):eta(5)-2,4,6,8-tetramethyl-s-indaceneiide)-FeCp*] (3) and trimetallic [Fe-bis{Cp*Fe-(mu:eta(5):eta(5)-2,4,6,8-tetramethyl-s-indaceneiide)}] (4) complexes. All complexes here reported were characterized by means of H-1, C-13 NMR, mass spectrometry, elemental analysis, together with cyclic voltammetry. In addition, these complexes have been studied by DFT methods in order to gain further knowledge about its electronic structure. In addition, the possibility to generate organometallic polymers employing the complexes here reported, is proposed theoretically with the study of an oligomer titled as [Cp*(Fe(Ic')}(4)FeCp*], 6(t). (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2013.11.023