[ReCl(P(C6H5)3)(L1)2] | 269082-90-8

• 英文名称: [ReCl(P(C6H5)3)(L1)2]
• CAS: 269082-90-8；916980-21-7
• 化学式: C₃₀H₂₅ClN₆O₄PRe
• 分子量: 786.2
• InChiKey: LAFOCQBIRJUAQZ-UHFFFAOYSA-M

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：

  trans-[ReOCl3(PPh3)2] 、 3-硝基邻苯二胺 以 乙醇 为溶剂， 以62%的产率得到[ReCl(P(C6H5)3)(L1)2]
  参考文献：
  名称：

  The reaction of nitro-1,2-diaminobenzenes with the [ReO]3+ core: isolation of oxo-free rhenium(V) complexes

  摘要：

  The reaction of 2 equiv. of 3-nitro-1.2-diaminobenzene (H2L1) with trans-ReOCl3(PPh3)(2) in ethanol gave the ore-free rhenium(V) complex [ReCl(PPh3)(L-1)(2)] (1) in good yield. IR, H-1 NMR and X-ray crystallographic results indicate that the diamine ligand L-1 coordinates in a dianionic bidentate diamido form to the metal, and that the complex has the unusual skew-trapezoidal bipyramidal geometry. With 4-nitro-1,2-diaminobenzene (H2L2) as ligand the complex [Re(L-2)Cl-3(PPh3)(2)] (2) was characterized, in which L-2 coordinates in a dianionic monodentate imido form through one nitrogen only. Crystal data for 1-EtOH: C32H31CIN6O5PRe, monoclinic P2(1)/c, a = 14.937(11), b = 15.017(8), c = 15.394(12) Angstrom, beta = 112.12(6)degrees, V = 3198.7(38) Angstrom(3), Z = 4, D-calc = 1.728 g cm(-3), structure solution and refinement based on 3151 reflections converged at R = 0.0807. (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0020-1693(99)00497-1