N,N'-di(2-methoxyphenyl)formamidine*copper(II) chloride | 850220-13-2

• 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: N,N'-di(2-methoxyphenyl)formamidine*copper(II) chloride
• 英文别名: o-HDMophF*CuCl2
• CAS: 850220-13-2
• 化学式: C₁₅H₁₆N₂O₂*Cl₂Cu
• 分子量: 390.756
• InChiKey: IMZXBMVRNGRCBV-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  4.85
• 重原子数：
  22.0
• 可旋转键数：
  5.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  42.85
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为产物：
  描述：

  copper(II) choride dihydrate 、 N,N'-bis(2-methoxyphenyl)formamidine 以 二氯甲烷 为溶剂， 以56%的产率得到N,N'-di(2-methoxyphenyl)formamidine*copper(II) chloride
  参考文献：
  名称：

  Synthesis and structural characterization of metal halide complexes containing N,N′-di(2-methoxyphenyl)formamidine (o-HDMophF)

  摘要：

  The reactions of N,N'-di(2-methoxyphenyl)formamidine (o-HDMophF) with transition metal halide complexes afforded CuCl2 center dot (o-HDMophF), 1, [CoX4][o-H(2)DMophF](2) (X = Cl, 2; Br, 3) and MCl2(o-HDMophF)(2) (M = Cd, 4; Ni, 5; Mn, 6; Pd, 7). These complexes were characterized by single-crystal X-ray diffraction and elemental analyses. The neutral o-HDMophF ligands in complexes 4-6 and 7 are coordinated to the metal centers in new bidentate and monodentate fashions, respectively. In the crystal structures of 1-7, C-H center dot center dot center dot X and/or N-H center dot center dot center dot X (X = Cl, Br) interactions are found to link the metal units to the o-HDMophF ligand, or its protonated cation (o-H(2)DMophF(+)). The neutral o-HDMophF compound in 1 adopts the s-trans-anti-s-trans-conformation, while those in complexes 4-6 and 7 adopt the s-trans-anti-s-trans- and s-cis-anti-s-trans-conformations, respectively. The o-H(2)DMophF(+) cations of complexes 2 and 3 adopt the s-cis-syn-anti-s-trans and s-trans-anti-anti-s-trans conformations. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2004.12.012