1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene | 36772-40-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene
• 英文别名: N'-[(E)-pyridin-2-ylmethylideneamino]pyridine-2-carboximidamide
• CAS: 36772-40-4
• 化学式: C₁₂H₁₁N₅
• 分子量: 225.253
• InChiKey: RSFAFOBXOXFBID-CXUHLZMHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  76.5
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  cadmium(II) perchlorate hexahydrate 、 1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene 、 potassium thioacyanate 以 甲醇 为溶剂， 以69.5%的产率得到tetrakis(μ-1,3-thiocyanato)(1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene)dicadmium(II)
  参考文献：
  名称：

  Four thiocyanato-bridged cadmium(II) polymeric complexes based on open chain diazine ligands

  摘要：

  One 1 D and three 3D thiocyanate cadmium(II) polymeric complexes with a series of open chain diazine Schiff bases as auxiliary bridging ligands have been synthesized and crystallographically characterized. In the 1D complex [Cd(L-1)(mu(1,3)-NCS)(4)](n) (1, L-1 = 1-(2-pyridyl)-4-phenyl-1-amino-2,3-diaza-1,3-butadiene), cadmium(II) ions are interlinked by double mu-1,3 thiocyanate ligands resulting in a 1D chain running along a direction. The three 3D complexes are isostructural with general formula of [Cd-2(L2-4)(mu(1,3)-NCS)(2)](n) (2-4, respectively, L-2 = 1,4-bis(2-pyridyl)-1,4-diamino-2,3-diaza-1,3-butadiene, L-3 = 1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene, L-4 = 1,4-bis(2-pyridyl)-1-amino-4-methyl-2,3-diaza-1,3-butadiene). In the complexes of 2-4, the double mu-1,3 thiocyanate ligands form a chain and the chains are further interlinked by single diazine ligands into a three-dimensional (10,3)-b net with each cadmium ion as a node. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2007.04.002

文献信息

• From Achiral Ligands to Chiral Coordination Polymers:  Spontaneous Resolution, Weak Ferromagnetism, and Topological Ferrimagnetism
  作者：En-Qing Gao、Yan-Feng Yue、Shi-Qiang Bai、Zheng He、Chun-Hua Yan

  DOI：10.1021/ja039104a

  日期：2004.2.1

  3-diaza-1,3-butadiene) induces spontaneous resolution, yielding conglomerates of chiral compounds [Mn(3)(L(1))(2)(N(3))(6)](n) (1) and [Mn(2)(L(2))(2)(N(3))(3)](n)(ClO(4))(n).nH(2)O (2), respectively, where triangular (1) or double helical (2) chiral units are connected into homochiral one-dimensional (1D) chains via single end-to-end (EE) azido bridges. The chains are stacked via hydrogen bonds in a

  使用带有两个双齿吡啶亚氨基的非手性二嗪配体作为构象手性的来源，制备了五种叠氮桥配位聚合物，并在晶体学和磁性上进行了表征。分子单元的手性是由二嗪配体以扭曲的手性构象配位引起的。L(1) (1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene) 和 L(2) (1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene) 和 L(2) (1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene) 和 L(2) (1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene) 和 L(2) (1,4-bis(2-pyridyl) )-1,4-二氨基-2,3-二氮杂-1,3-丁二烯) 诱导自发拆分，产生手性化合物 [Mn(3)(L(1))(2)(N(3))(
• Four thiocyanato-bridged cadmium(II) polymeric complexes based on open chain diazine ligands
  作者：Yan-Feng Yue、Chen-Jie Fang、En-Qing Gao、Cheng He、Shi-Qiang Bai、Sheng Xu、Chun-Hua Yan

  DOI：10.1016/j.molstruc.2007.04.002

  日期：2008.3

  One 1 D and three 3D thiocyanate cadmium(II) polymeric complexes with a series of open chain diazine Schiff bases as auxiliary bridging ligands have been synthesized and crystallographically characterized. In the 1D complex [Cd(L-1)(mu(1,3)-NCS)(4)](n) (1, L-1 = 1-(2-pyridyl)-4-phenyl-1-amino-2,3-diaza-1,3-butadiene), cadmium(II) ions are interlinked by double mu-1,3 thiocyanate ligands resulting in a 1D chain running along a direction. The three 3D complexes are isostructural with general formula of [Cd-2(L2-4)(mu(1,3)-NCS)(2)](n) (2-4, respectively, L-2 = 1,4-bis(2-pyridyl)-1,4-diamino-2,3-diaza-1,3-butadiene, L-3 = 1,4-bis(2-pyridyl)-1-amino-2,3-diaza-1,3-butadiene, L-4 = 1,4-bis(2-pyridyl)-1-amino-4-methyl-2,3-diaza-1,3-butadiene). In the complexes of 2-4, the double mu-1,3 thiocyanate ligands form a chain and the chains are further interlinked by single diazine ligands into a three-dimensional (10,3)-b net with each cadmium ion as a node. (C) 2007 Elsevier B.V. All rights reserved.