[gold(μ-4-bromo-3,5-diphenylpyrazolato)]₃ | 1415012-54-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: [gold(μ-4-bromo-3,5-diphenylpyrazolato)]₃
• 英文别名: [Au(μ-4-Br-3,5-Ph₂-pz)]₃
• CAS: 1415012-54-2
• 化学式: C₄₅H₃₀Au₃Br₃N₆
• 分子量: 1485.38
• InChiKey: HLKJKQOEQABYMD-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：

  (tetrahydrothiophene)gold(I) chloride 、 4-bromo-3,5-diphenyl-1H-pyrazole 以 四氢呋喃 为溶剂， 反应 12.0h， 以60%的产率得到[gold(μ-4-bromo-3,5-diphenylpyrazolato)]₃
  参考文献：
  名称：

  Substituent Effects on the Supramolecular Aggregation of Ag^I-Pyrazolato Trimers

  摘要：

  The interplay of argentophilic and dipolar (pi-acid center dot center dot center dot base) interactions, on one hand, and the presence or absence of interstitial solvent molecules, on the other, determines the supramolecular organization of trinuclear silver-pyrazolato complexes in the solid state. The crystal structures of one gold and six silver metallacyclic complexes of the type [M-I(mu-pz*)](3), where pz* are the substituted pyrazolato anions 3,5-Ph-2-pz, 3-Me-5-Ph-pz, 4-Br-3,5-Ph-2-pz, 4-Br-3-Bu-t-pz and 3-(o-Cl-C6H4)-pz and M = Ag and Au, are discussed in the context of their supramolecular organization. Two silver complexes, for which the pi-acid character of their Ag-3-faces is maximized by their peripheral electron-withdrawing substituents, show crystal packing dominated by short Ag-3 center dot center dot center dot Br contacts, the first structural manifestation of supramolecular structure via dipolar interactions involving the tunable it-acidity of the Ag-3-face.

  DOI：

  10.1021/cg301411j