[Fe6(N-(2-hydroxymethylphenyl)salicylideneimine)4] | 1318051-40-9

• 英文名称: [Fe6(N-(2-hydroxymethylphenyl)salicylideneimine)4]
• CAS: 1318051-40-9
• 化学式: C₈₄H₆₆Fe₄N₆O₁₂
• 分子量: 1574.87
• InChiKey: AJWRXRFBDKKUAX-DSVHIRIXSA-H

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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(III) nitrate nonahydrate 、 N-salicylidene-o-hydroxymethyleneaniline 在 Et₃N 作用下， 以 甲醇 为溶剂， 以73%的产率得到[Fe6(N-(2-hydroxymethylphenyl)salicylideneimine)4]
  参考文献：
  名称：

  A non-linear (2,2,2) alkoxo-bridging in a FeIII4O6 core potentially relevant to iron-tunicates

  摘要：

  The tridentate unsymmetrical ligand N-(2-hydroxymethylphenyl) salicylideneimine H2L, derived from salicylaldehyde and 2-aminobenzylalcohol, with [ONO] donor atoms yields [(L2Fe2Cl2)-Cl-III] (1) and [L6Fe4III] (2) complexes containing alkoxide bridges, which have been structurally characterized by X-ray diffraction. In complex 1, each ferric ion is five-coordinated with a distorted square-pyramidal geometry, the basal planes of which are symmetrically bridged by two alkoxide oxygen atoms. Analysis of the susceptibility data reveals antiferromagnetic interactions with an exchange parameter J = -15.8 cm(-1) between the high-spin d(5) ferric centers. The structure of 2 can be considered as "linear (2,2,2)'' to specify the number of enolate oxygen atoms between four iron atoms. Variable-temperature magnetic susceptibility data are fitted to a "three-J'' model, yielding pairwise antiferromagnetic exchange interactions, J(12) = J(34) = -13.4 cm(-1),J(13) = J(24) = -7.1 cm(-1),J(23) = -14.9 cm(-1), between the neighboring ferric centers; J(14) is assumed to be negligible. Complex 2 has a complicated low-lying magnetic structure with a non-diamagnetic ground state. In addition, the Fe-O-Fe angles at the bridging ligands seem to be determinant for the strength of the antiferromagnetic interactions. (C) 2011 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2011.01.107