CoCl(2,2'-bipyridine)2(1,3,5-triaza-7-phosphaadamantane)BF4 | 1227999-23-6

• 英文名称: CoCl(2,2'-bipyridine)2(1,3,5-triaza-7-phosphaadamantane)BF4
• CAS: 1227999-23-6
• 化学式: BF₄*C₂₆H₂₈ClCoN₇P
• 分子量: 650.78
• InChiKey: QGDYMAHJULDKPM-UHFFFAOYSA-M

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：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  CoCl(2,2'-bipyridine)2(1,3,5-triaza-7-phosphaadamantane)BF4 、 水 以 水 为溶剂， 生成 CoCl(2,2'-bipyridine)2(1,3,5-triaza-7-phosphaadamantane-7-oxide)BF4
  参考文献：
  名称：

  Synthesis of the first monodentate S- and O-coordinating 1,3,5-triaza-7-phosphaadamantane-7-chalcogenides [CoCl(bpy)2(Z-PTAZ)]X (ZS, O; bpy=2,2′-bipyridine; X=BF4, PF6) and [CoCl(bpy)2(N-PTA)]BF4 (PTA=1,3,5-triaza-7-phosphaadamantane)

  摘要：

  The Coll compounds [CoCl(bpy)(2)(S-PTA=S)]X, [CoCl(bpy)(2)(O-PTA=O)]X [PTA=S = 1,3,5-triaza-7-phosphaadamantane-7-sulfide (1); PTA=O = 1,3,5-triaza-7-phosphaadamantane-7-oxide (2); bpy = 2,2'-bipyridine; X = BF4 (1a, 2a), X = PF6 (1b, 2b)] and (CoCl(bpY)(2)(N-PTA)BF4 have been prepared by reacting anhydrous CoCl2 with PTA=S, PTA=O and PTA, respectively, in ethanol at room temperature in presence of bpy and NaBF4 or NaPF6. They are soluble in polar solvents such as water and Me2SO, and have been characterized by IR, H-1, P-31{H-1) NMR, ESI-MS, elemental analyses and (for 2a) single crystal X-ray diffraction structural analysis. The molecular structures bear two molecules of bpy and one PTA=Z. Compounds 1a and 1b represent the first reported transition metal complexes of PTA=S and additionally 1 and 2, are the first examples of transition metal complexes bearing both bpy (or any polypyridyl) and PTA-cage ligands. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.02.004
• 作为产物：
  描述：

  2,2'-联吡啶 、 氟硼酸钠 、 1,3,5-三氮杂-7-磷杂金刚烷 、 cobalt(II) chloride 以 乙醇 为溶剂， 以85%的产率得到CoCl(2,2'-bipyridine)2(1,3,5-triaza-7-phosphaadamantane)BF4
  参考文献：
  名称：

  Synthesis of the first monodentate S- and O-coordinating 1,3,5-triaza-7-phosphaadamantane-7-chalcogenides [CoCl(bpy)2(Z-PTAZ)]X (ZS, O; bpy=2,2′-bipyridine; X=BF4, PF6) and [CoCl(bpy)2(N-PTA)]BF4 (PTA=1,3,5-triaza-7-phosphaadamantane)

  摘要：

  The Coll compounds [CoCl(bpy)(2)(S-PTA=S)]X, [CoCl(bpy)(2)(O-PTA=O)]X [PTA=S = 1,3,5-triaza-7-phosphaadamantane-7-sulfide (1); PTA=O = 1,3,5-triaza-7-phosphaadamantane-7-oxide (2); bpy = 2,2'-bipyridine; X = BF4 (1a, 2a), X = PF6 (1b, 2b)] and (CoCl(bpY)(2)(N-PTA)BF4 have been prepared by reacting anhydrous CoCl2 with PTA=S, PTA=O and PTA, respectively, in ethanol at room temperature in presence of bpy and NaBF4 or NaPF6. They are soluble in polar solvents such as water and Me2SO, and have been characterized by IR, H-1, P-31{H-1) NMR, ESI-MS, elemental analyses and (for 2a) single crystal X-ray diffraction structural analysis. The molecular structures bear two molecules of bpy and one PTA=Z. Compounds 1a and 1b represent the first reported transition metal complexes of PTA=S and additionally 1 and 2, are the first examples of transition metal complexes bearing both bpy (or any polypyridyl) and PTA-cage ligands. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.02.004