[Cu2(2,2'-bipyridine)2(1,2,4,5-benzenetetracarboxylate)] | 690224-94-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: [Cu2(2,2'-bipyridine)2(1,2,4,5-benzenetetracarboxylate)]
• 英文别名: [Cu2(btec)(2,2'-bipy)2]
• CAS: 690224-94-3；732282-98-3；383912-36-5
• 化学式: C₃₀H₁₈Cu₂N₄O₈
• 分子量: 689.587
• InChiKey: FMHXDSZXWSLZQX-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 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：

  [Cu2(2,2'-bipyridine)2(1,2,4,5-benzenetetracarboxylate)] 以 neat (no solvent) 为溶剂， 生成 copper(II) oxide
  参考文献：
  名称：

  Hydrothermal synthesis and crystal structure of an infinite 1D ladderlike metal-organic compound: [Cu2(btec)(2,2′-bipy)2]∞ (btec=1,2,4,5-benzenetetracarboxylate)

  摘要：

  A new metal-organic hybrid compound [Cu-2(btec)(2,2'-bipy)(2)](infinity) (btec = 1,2,4,5-benzenetetracarboxylate) has been hydrothermally synthesized and characterized by elemental analyses, IR spectrum, TG analysis and single-crystal X-ray diffraction. Dark-blue crystals crystallizes in the monoclinic system, space group P2(1)/n, a = 7.2587(15) Angstrom, b = 12.396(3) Angstrom, c = 14.428(3) Angstrom, beta = 103.87(3)degrees, V = 1260.4(4) Angstrom(3), Z = 2, R1 = 0.0553, wR2 = 0.1746. The title compound exhibits a new infinite 1D ladderlike chain architecture constructed from the {Cu(2,2'-bipy)}(2+) moieties and btec ligands. Furthermore, the adjacent chains are stacked into a 3D supramolecular framework via pi-pi stacking interactions of bipy groups and intermolecular hydrogen bonding interactions. (C) 2003 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/s0022-2860(03)00349-1
• 作为产物：
  描述：

  2,2'-联吡啶 、 均苯四甲酸 、 copper(II) acetate monohydrate 在 NaOH 作用下， 以 水 为溶剂， 以90%的产率得到[Cu2(2,2'-bipyridine)2(1,2,4,5-benzenetetracarboxylate)]
  参考文献：
  名称：

  Hydrothermal synthesis and crystal structure of an infinite 1D ladderlike metal-organic compound: [Cu2(btec)(2,2′-bipy)2]∞ (btec=1,2,4,5-benzenetetracarboxylate)

  摘要：

  A new metal-organic hybrid compound [Cu-2(btec)(2,2'-bipy)(2)](infinity) (btec = 1,2,4,5-benzenetetracarboxylate) has been hydrothermally synthesized and characterized by elemental analyses, IR spectrum, TG analysis and single-crystal X-ray diffraction. Dark-blue crystals crystallizes in the monoclinic system, space group P2(1)/n, a = 7.2587(15) Angstrom, b = 12.396(3) Angstrom, c = 14.428(3) Angstrom, beta = 103.87(3)degrees, V = 1260.4(4) Angstrom(3), Z = 2, R1 = 0.0553, wR2 = 0.1746. The title compound exhibits a new infinite 1D ladderlike chain architecture constructed from the {Cu(2,2'-bipy)}(2+) moieties and btec ligands. Furthermore, the adjacent chains are stacked into a 3D supramolecular framework via pi-pi stacking interactions of bipy groups and intermolecular hydrogen bonding interactions. (C) 2003 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/s0022-2860(03)00349-1