[Cd(η2-(2-chloro-4-ferrocenylbenzoate))2(1,4-bis(benzimidazole-1-yl)benzene)]n | 1196366-66-1

• 英文名称: [Cd(η2-(2-chloro-4-ferrocenylbenzoate))2(1,4-bis(benzimidazole-1-yl)benzene)]n
• 英文别名: [Cd(η2-OOCClH3C6Fc)2(pbbbm)]n
• CAS: 1196366-66-1
• 化学式: C₅₆H₄₂CdCl₂Fe₂N₄O₄
• 分子量: 1129.98
• InChiKey: GAVXDBPPFIHZOU-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：

  [Cd(η2-(2-chloro-4-ferrocenylbenzoate))2(H2O)3](methanol)2 、 1,4-bis(benzimidazole-1-ylmethyl)benzene 以 四氢呋喃 、 甲醇 为溶剂， 以55%的产率得到[Cd(η2-(2-chloro-4-ferrocenylbenzoate))2(1,4-bis(benzimidazole-1-yl)benzene)]n
  参考文献：
  名称：

  Three 1-D complexes generated from a ferrocenyl carboxylate cadmium(II) precursor through substitution reactions of N-containing ligands: Syntheses, crystal structures and electrochemical properties

  摘要：

  Using sodium 2-chloro-4-ferrocenylbenzoate as functional ligand, a mononuclear precursor complex [Cd(eta(2)-OOCClH(3)C(6)Fc)(2)(H2O)(3)](CH3OH)(2)} P1 [Fc = (eta(5)-C5H5)Fe(eta(5)-C5H4)] was synthesized, which containing facile leaving groups. The substitution reactions of the precursor ferrocenyl carboxylate complex with basic N-containing ligands gave three 1-D polymers [Cd-2(mu(2)-OOCClH(3)C(6)Fc)(4)(bix)](n) 1 [bix = 1,4-bis(imidazol-1-ylmethyl)benzene)], {[Cd-2(eta(2)-OOCClH(3)C(6)Fc)(3)(eta-OOCClH(3)C(6)Fc)(mbbbm)(2)](CH3OH)(2)}(n) 2 [mbbbm = 1,3-bis(benzimidazole-1-ylmethyl)benzene] and [Cd(eta(2)-OOCClH(3)C(6)Fc)(2)(pbbbm)](n) 3 [pbbbm = 1,4-bis(benzimidazole-1-ylmethyl) benzene]. Single-crystal X-ray analysis reveals that the 1D chain structures of polymers 1-3 are bridged by bix, mpbbbm and pbbbm, respectively, and the three polymers present some differences in their structures. Our results also show that the structural integrity of the precursor complex can be maintained in the resultant polymers. Electrochemical studies of the four complexes in THF/CH3OH solution indicate that the half-wave potentials of the ferrocenyl moieties in these complexes are all shifted to positive potential compared with that of free 2-chloro-4-ferrocenylbenzoic acid. (C) 2009 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2009.06.035