[Co(N,N'-bis(pyridin-4-ylmethylene)naphthalene-1,5-diamine)(biphenyl-4,4'-dicarboxylate)]*ethanol | 954375-86-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [Co(N,N'-bis(pyridin-4-ylmethylene)naphthalene-1,5-diamine)(biphenyl-4,4'-dicarboxylate)]*ethanol
• CAS: 954375-86-1
• 化学式: C₂H₆O*C₁₄H₈O₄*C₂₂H₁₆N₄*Co
• 分子量: 681.673
• InChiKey: YFNDXLRLHKKCOF-OXBZONAHSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  5.21
• 重原子数：
  48.0
• 可旋转键数：
  7.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  150.99
• 氢给体数：
  1.0
• 氢受体数：
  9.0

反应信息

• 作为产物：
  描述：

  cobalt(II) nitrate hexahydrate 、 乙醇 、 N,N'-bis(pyridin-4-ylmethylene)naphthalene-1,5-diamine 、 檀香(SANTALUMALBUM)提取物 以 乙醇 、 N,N-二甲基甲酰胺 为溶剂， 以73%的产率得到[Co(N,N'-bis(pyridin-4-ylmethylene)naphthalene-1,5-diamine)(biphenyl-4,4'-dicarboxylate)]*ethanol
  参考文献：
  名称：

  Cobalt(II) coordination polymers based on dicarboxylates and dipyridyl-type ligands: [CoL1.5(NO3)2], [Co1.5(bpdc)1.5(dma)]·(dma)·(EtOH), [Co1.5(ndc)1.5(dma)2], [Co3(ndc)3(dmf)4], and [CoL(bpdc)]·(EtOH) (bpdcH2=biphenyl-4,4′-dicarboxylic acid, ndcH2=2,6-naphthalene dicarboxylic acid, L=pyCHNC10H6NCHpy)

  摘要：

  Under solvothermal conditions, a 1-D ladder polymer [CoL1.5(NO3)(2)] (1) was prepared from Co(NO3)(2)center dot 6H(2)O and a dipyridyl-type ligand. N,N '-bis-pyridin-4-ylmethylene-naphthalene-1,5-diamine (L) in methanol. Co(NO3)(2)center dot 6H(2)O reacted with dicarboxylic acids such as biphenvl-4,4 '-dicarboxylic acid (bpdcH(2)) and 2,6-naphthalene dicarboxylic acid (ndcH(2)) in dma-ethanol to produce 3-D polymers, [Co-1.5(bpdc)(1.5)(dma)]center dot(dma)-(EtOH) (2) and [Co-1.5(ndc)(1.5)(dma)(2)] (3), respectively. In dmf-ethanol, another 3-D polymer [Co-3(ndc)(3)(dmf)(4)] (4) was prepared from Co(NO3)(2)center dot 6H(2)O and ndcH(2). Finally, a 3-D polymer [CoL(bpdc)]-(EtOH) (5), whose framework is made up of bpdc(2-) and L, could be prepared. All polymers were structurally characterized by X-ray diffraction. Polymers 2 and 5 p contain guest molecules in their frameworks. (C) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2006.11.065