[Fe2(N,N'-dimethyl-bis(3,5-dichloro-2-oxybenzyl)-1,2-diaminoethane)3] | 1318754-30-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [Fe2(N,N'-dimethyl-bis(3,5-dichloro-2-oxybenzyl)-1,2-diaminoethane)3]
• CAS: 1318754-30-1
• 化学式: C₅₄H₅₄Cl₁₂Fe₂N₆O₆
• 分子量: 1420.19
• InChiKey: BVBAGILMZUTFRH-UHFFFAOYSA-H

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：

  iron perchlorate hexahydrate 、 N,N'-dimethyl-N,N'-bis[(3,5-dichloro-2-hydroxyphenyl)methylene]-1,2-diaminoethane 在 N(C₂H₅)3 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 以61%的产率得到[Fe2(N,N'-dimethyl-bis(3,5-dichloro-2-oxybenzyl)-1,2-diaminoethane)3]
  参考文献：
  名称：

  Synthesis and characterization of a dinuclear ferric complex with redox-active ligands

  摘要：

  A dinuclear ferric complex with the redox-active ligand (L-Cl2)(2-) (H2LCl2 = N,N'-dimethyl-bis(3,5-dichloro-2-hydroxybenzyl)-1,2-diaminoethane), was synthesized and characterized. The two iron(III) ions are six-coordinate in a distorted octahedral environment of the N2O2Ph donor set of one (L-Cl2)(2) and one amine and one phenolate donor of a second (L-Cl2)(2), which bridges the two complex halves. The relatively low-symmetric complex 1 crystallizes in the space group R (3) over bar. The crystal structure contains hexagonal, one-dimensional channels parallel to the c axis with diameters of similar to 13 angstrom. The absorption spectrum of 1 exhibits strong characteristic features of p(pi) -> d(pi*) ->, p(pi) -> d(sigma*), phenolate-to-metal CTs, and pi -> pi* ligand transitions. Electrochemical studies on 1 reveal the redox-activity of the coordinated ligand (L-Cl2)(2) by showing irreversible oxidative electron-transfer waves. The reductive electron transfers at negative potentials seem to originate from metal-centered processes. A detailed comparison to complexes with similar donor sets provides new insights into the electrochemical properties of these kinds of complexes. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2011.03.059