[Cu2(μ1,1-azido)2(azido)2(bis(3,5-dimethylpyrazol-1-yl)methane)2] | 1341187-20-9

• 英文名称: [Cu2(μ1,1-azido)2(azido)2(bis(3,5-dimethylpyrazol-1-yl)methane)2]
• CAS: 1341187-20-9
• 化学式: C₂₂H₃₂Cu₂N₂₀
• 分子量: 703.722
• InChiKey: MJSZMMFVVHAHDN-UHFFFAOYSA-N

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：
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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：

  copper(II) choride dihydrate 、 1-[(3,5-二甲基吡唑-1-基)甲基]-3,5-二甲基吡唑 、 sodium azide 以 甲醇 、 水 为溶剂， 以65%的产率得到[Cu2(μ1,1-azido)2(azido)2(bis(3,5-dimethylpyrazol-1-yl)methane)2]
  参考文献：
  名称：

  Cu(II), Cd(II) and Ni(II) azide complexes incorporating bis(3,5-dimethylpyrazol-1-yl)methane – Synthesis, spectroscopic characterisation, X-ray studies and magnetic properties

  摘要：

  Three novel compounds [Cu-2(mu(1.1)-N-3)(2)(N-3)(2)(bdmpzm)(2)] (1) [Cd(N-3)(2)(bdmpzm)](n) (2) and [Ni(N-3)(2)(bdmpzm)(2)] (3) have been synthesised and characterised structurally and spectroscopically. The structure 1 consists of a neutral dinuclear [Cu-2(mu(1.1)-N-3)(2)(N-3)(2)(bdmpzm)(2)] entities, compound 2 has one-dimensional zigzag chain structure extending along the crystallographic direction [100] with alternating di-mu(1.1)-N-3 and di-mu(1.3)-N-3 bridges, and 3 is a mononuclear complex. The experimental studies on the nickel(II) complex have been accompanied computationally by the density functional theory (DFT) calculations. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2011.08.007