[zinc(II)(diacetylacetonate)(o-chlorophenylthiourea)] | 943726-97-4

• 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: [zinc(II)(diacetylacetonate)(o-chlorophenylthiourea)]
• 英文别名: [Z(acac)2(OCPT)]
• CAS: 943726-97-4
• 化学式: C₁₇H₂₁ClN₂O₄SZn
• 分子量: 450.274
• InChiKey: FLVUJFGFMOBIDV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  乙酰丙酮锌 、 邻氯苯基硫脲 以 丙酮 为溶剂， 以59%的产率得到[zinc(II)(diacetylacetonate)(o-chlorophenylthiourea)]
  参考文献：
  名称：

  A new screw shaped coordination compound for crystal engineering: Synthesis, crystal structure and nonlinear optical effect of o-chlorophenylthiourea zinc (II) diacetylacetonate

  摘要：

  This paper presents the synthesis and crystal structure of a new screw shaped square-pyramidal coordination compound, Zn(OCP-T)(acac)(2)(OCPT is o-chlorophenylthiourea). In the molecule, the "tail" length is almost equal to the width of the "head". The compound crystallizes in a noncentrosymmetric structure. The molecules are arranged in almost parallel direction. The compound showed the powder SHG (second harmonic generation) effect of about 1.5 times as large as that of KDP. (C) 2006 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2006.05.034