(N'1E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide

• 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: (N'1E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide
• 英文别名: N,N'-bis[(E)-[phenyl(pyridin-2-yl)methylidene]amino]oxamide
• 化学式: C₂₆H₂₀N₆O₂
• 分子量: 448.484
• InChiKey: JQKCJMDJJIIKBP-HCTXVGCHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  109
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  二氯甲烷 、 (N'1E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide 、 bis(triphenylphosphane)copper(I) nitrate 以 甲醇 为溶剂， 反应 24.0h， 以70%的产率得到[Cu₂(bpoh)(PPh₃)₄]*2CH₂Cl₂
  参考文献：
  名称：

  Binuclear Cu(I) complex of (N′1E,N′2E)-N′1,N′2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide: Synthesis, crystal structure and catalytic activity for the synthesis of 1,2,3-triazoles

  摘要：

  A new binuclear 5-coordinate distorted trigonal bipyramidal Cu(I) complex with (NI E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl) methylene) oxalohydrazide (H(2)bpoh) has been synthesized, and characterized by spectroscopic and single crystal X-ray diffraction techniques. In the complex, H2bpoh acts as a dibasic hexadentate ligand bonding with two Cu(l) each through a carbonylate-0, azomethine-N, and pyridyl-N atoms. The complex possess a CuN2OP2 core with a considerable delocalization of charge on the fivemembered chelate rings which forms an unusual intra-molecular pi-pi stacking and C-H center dot center dot center dot pi interactions. The synthesized complex exhibits excellent catalytic efficiency for a click reaction at room temperature. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2014.12.003
• 作为产物：
  描述：

  乙二酸二酰肼 、 2-苯甲酰吡啶 以 甲醇 、 水 为溶剂， 反应 20.0h， 以80%的产率得到(N'1E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide
  参考文献：
  名称：

  Binuclear Cu(I) complex of (N′1E,N′2E)-N′1,N′2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide: Synthesis, crystal structure and catalytic activity for the synthesis of 1,2,3-triazoles

  摘要：

  A new binuclear 5-coordinate distorted trigonal bipyramidal Cu(I) complex with (NI E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl) methylene) oxalohydrazide (H(2)bpoh) has been synthesized, and characterized by spectroscopic and single crystal X-ray diffraction techniques. In the complex, H2bpoh acts as a dibasic hexadentate ligand bonding with two Cu(l) each through a carbonylate-0, azomethine-N, and pyridyl-N atoms. The complex possess a CuN2OP2 core with a considerable delocalization of charge on the fivemembered chelate rings which forms an unusual intra-molecular pi-pi stacking and C-H center dot center dot center dot pi interactions. The synthesized complex exhibits excellent catalytic efficiency for a click reaction at room temperature. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2014.12.003

文献信息

• Binuclear Cu(I) complex of (N′1E,N′2E)-N′1,N′2-bis(phenyl(pyridin-2-yl)methylene)oxalohydrazide: Synthesis, crystal structure and catalytic activity for the synthesis of 1,2,3-triazoles
  作者：Divya Pratap Singh、Bharat Kumar Allam、Krishna Nand Singh、Vinod Prasad Singh

  DOI：10.1016/j.molcata.2014.12.003

  日期：2015.3

  A new binuclear 5-coordinate distorted trigonal bipyramidal Cu(I) complex with (NI E,N'2E)-N'1,N'2-bis(phenyl(pyridin-2-yl) methylene) oxalohydrazide (H(2)bpoh) has been synthesized, and characterized by spectroscopic and single crystal X-ray diffraction techniques. In the complex, H2bpoh acts as a dibasic hexadentate ligand bonding with two Cu(l) each through a carbonylate-0, azomethine-N, and pyridyl-N atoms. The complex possess a CuN2OP2 core with a considerable delocalization of charge on the fivemembered chelate rings which forms an unusual intra-molecular pi-pi stacking and C-H center dot center dot center dot pi interactions. The synthesized complex exhibits excellent catalytic efficiency for a click reaction at room temperature. (C) 2014 Elsevier B.V. All rights reserved.