CuCl(N-(methylpentylcarbamothioyl)benzamide)(PPh3)2 | 1357472-99-1

• 英文名称: CuCl(N-(methylpentylcarbamothioyl)benzamide)(PPh3)2
• CAS: 1357472-99-1
• 化学式: C₅₀H₅₀ClCuN₂OP₂S
• 分子量: 887.972
• InChiKey: JROPBHWSWVUKNI-UHFFFAOYSA-M

计算性质

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

反应信息

• 作为产物：
  描述：

  [CuCl₂(PPh₃)₂] 、 N-(methylpentylcarbamothioyl)benzamide 以 苯 为溶剂， 以85%的产率得到CuCl(N-(methylpentylcarbamothioyl)benzamide)(PPh3)2
  参考文献：
  名称：

  Hypodentate coordination of N,N-di(alkyl/aryl)-N′-acylthiourea derivatives in Cu(I) complexes

  摘要：

  New four-coordinated tetrahedral Cu(I) complexes of the general formula [CuCl(HL)(PPh3)(2)] have been synthesized from the reactions between [CuCl2(PPh3)(2)] and N-(dibenzylcarbamothioyl)benzamide (HL1) or N-(methylpentylcarbamothioyl)benzamide (HL2) in benzene. The complexes have been characterized by elemental analyses, IR, UV-Vis, H-1, C-13 and P-31 NMR spectroscopy. The molecular structures of [CuCl(HL1)(PPh3)(2)] (1) and [CuCl(HL2)(PPh3)(2)] (2) were determined by single crystal X-ray crystallography. Each complex displays a distorted tetrahedral, ClP2S, coordination geometry with hypodentate coordination of acylthiourea ligands which coordinate the Cu(I) centre through sulfur atom exclusively. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2011.12.002