[Cu(2-benzoylpyridine-N(4)-phenylsemicarbazone)Cl2]*H2O | 1265631-73-9

• 英文名称: [Cu(2-benzoylpyridine-N(4)-phenylsemicarbazone)Cl2]*H2O
• CAS: 1265631-73-9
• 化学式: C₁₉H₁₆Cl₂CuN₄O*H₂O
• 分子量: 468.83
• InChiKey: WTSNGIHJNFGZOH-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  copper(II) choride dihydrate 、 BPS 以 甲醇 为溶剂， 生成 [Cu(2-benzoylpyridine-N(4)-phenylsemicarbazone)Cl2]*H2O
  参考文献：
  名称：

  Synthesis, spectral characterization and crystal structure of copper(II) complexes of 2-benzoylpyridine-N(4)-phenylsemicarbazone

  摘要：

  An interesting series of nine new copper(II) complexes [Cu2L2(OAc)(2)]center dot H2O (1), [CuLNCS]center dot 1/2H(2)O (2), [CuL-NO3].1/2H(2)O (3), [Cu(HL)Cl-2]center dot H2O (4), [Cu-2(HL)(2)(SO4)(2)]center dot 4H(2)O (5), [CuLClO4]center dot 1/2H(2)O (6), [CuLBr]center dot 1/2H(2)O (7), [CuL2]center dot H2O (8) and [CuLN3]center dot CH3OH (9) of 2-benzoylpyridine-N(4)-phenyl semicarbazone (HL) have been synthesized and physico-chemically characterized. The tridentate character of the semicarbazone is inferred from IR spectra. Based on the EPR studies, spin Hamiltonian and bonding parameters have been calculated. The g values, calculated for all the complexes in frozen DMF, indicate the presence of the unpaired electron in the d(x2-y2) orbital. The structure of the compound, [Cu2L2(OA)(2)] (1a) has been resolved using single crystal X-ray diffraction studies. The crystal structure revealed monoclinic space group P2(1)/n. The coordination geometry about the copper(II) in la is distorted square pyramidal with one pyridine nitrogen atom, the imino nitrogen, enolate oxygen and acetate oxygen in the basal plane, an acetate oxygen form adjacent moiety occupies the apical position, serving as a bridge to form a centrosymmetric dimeric structure. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.09.030