[Zn(Ldao)(NO3)2] | 1345825-51-5

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机含氧阴离子化合物
• 英文名称: [Zn(Ldao)(NO3)2]
• 英文别名: Bis(nitrato-kappaO)(3-oxapentane-1,5-diamine-kappa^3^N,O,N')zinc(II)；zinc;2-(2-aminoethoxy)ethanamine;dinitrate
• CAS: 1345825-51-5
• 化学式: C₄H₁₂N₄O₇Zn
• 分子量: 293.552
• InChiKey: JVMWYUQKZKYZDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.56
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  187
• 氢给体数：
  2
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  zinc(II) nitrate hexahydrate 、 2,2'-氧双(乙胺) 以 乙醇 为溶剂， 以28%的产率得到[Zn(Ldao)(NO3)2]
  参考文献：
  名称：

  Synthesis, Crystal Structure, and Spectra Properties of the Zinc(II) Complex With 1,5-diamino-3-oxapentane

  摘要：

  A novel complex of the zinc (II) nitrate with 1,5-diamino-3-oxapentane (L-dao), with the composition [Zn (L-dao) (NO3)(2)], was synthesized and characterized by elemental analyses and IR spectra. The crystal structure of the complex has been determined by the single-crystal X-ray diffraction. The molecular structure consists of an L-dao, two nitrate radicals, and a Zn (II) atom. In the complex, the Zn (II) atom is N, O, N'-chelated by an L-dao and is further coordinated by two nitrate anions in a distorted trigonal-bipyramidal geometry (tau = 0.66). The crystal structure is mainly stabilized by the intermolecular hydrogen bond.

  DOI：

  10.1080/15533174.2011.609226