| 1446443-38-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• CAS: 1446443-38-4
• 化学式: C₂N₃*C₁₅H₁₇N₂O*Cu
• 分子量: 370.901
• InChiKey: MQEQGTRQNUEMMR-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  2.26
• 重原子数：
  24.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  109.13
• 氢给体数：
  1.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  copper(II) perchlorate hexahydrate 、 1-[(2-ethylamino-ethylimino)-methyl]-naphthalen-2-ol 、 sodium dicyanamide 以 甲醇 、 水 为溶剂， 反应 1.0h， 以70%的产率得到
  参考文献：
  名称：

  Copper(II) complexes with tridentate N2O donor Schiff base isomers: Modulation of molecular and crystalline architectures through supramolecular interactions

  摘要：

  Four copper(II) complexes, [Cu(L-1)(mu-Cl)](n) (1), [Cu-2(L-2)(2)(mu-Cl)(2)] (2), [Cu(L-1)(mu(1,5)-NCNCN)](n) (3) and [Cu(L-2)(mu(1,5)-NCNCN)](n), (4), where HL1 = 1-[(2-dimethylamino-ethylimino)-methyl]-naphthalen-2-ol and HL2 = 1-[(2-ethylamino-ethylimino)-methyl]-naphthalen-2-ol, acting as tridentate N2O donor ligands, have been prepared and characterized by elemental analysis, IR and UV-Vis spectroscopy and single crystal X-ray diffraction studies. Complexes 1, 3 and 4 show polymeric chain structures, whereas 2 has a double chloride bridged dimeric structure. The existence of C-H center dot center dot center dot pi it interactions between the dimeric units of 2 gives rise to a 2D supramolecular network. Complex 3 shows a zipper structure through pi center dot center dot center dot pi interactions between two polymeric chains. Complex 4 shows hydrogen bonding interactions which produces a 2D hydrogen bonded structure and these 2D layers then show interlayer pi center dot center dot center dot pi interactions. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2013.04.045