diaquo glycylglycinato copper(II) | 53430-02-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: diaquo glycylglycinato copper(II)
• CAS: 53430-02-7
• 化学式: C₄H₁₀CuN₂O₅
• 分子量: 229.68
• InChiKey: XMEYRBUVDHFFEH-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：

  肌酸酐 、 diaquo glycylglycinato copper(II) 以 水 为溶剂， 生成
  参考文献：
  名称：

  X-ray crystal structure of a ternary copper(II) peptide creatinine complex, (Aquo)(Creatinine)(Glycylglycinato) copper(II) sesquihydrate

  摘要：

  The first creatinine ternary complex [Cu(gg)(H2O)(creat)]. 1.5 H2O (1) [gg = glycylglycine (2-), creat = creatinine] has been crystallized from aqueous solution. The coordination geometry about the copper is approximately square pyramidal with the tridentate glycylglycine dianion and the N(1) of creatinine occupying the corners of a square. The coordination sphere about the copper is completed by an axial water molecule, Cu-OW(1) distance 2.496(2) Angstrom. Another water molecule OW(2), Cu-OW(2) distance 2.907(2) Angstrom. extends qualitatively the coordination geometry to octahedral. A third water molecule OW(3) with an occupancy factor of 0.5 is disordered and is located between two complex units. The complete crystal structure is maintained by an extensive hydrogen-bonding network in which the three types of water molecules are involved.

  DOI：

  10.1016/0277-5387(95)00048-w