ZrCl3(para-nitrophenoxide)(pyridine)2 | 796043-62-4

• 英文名称: ZrCl3(para-nitrophenoxide)(pyridine)2
• 英文别名: ZrCl3(OC6H4NO2-p)(py)2
• CAS: 796043-62-4
• 化学式: C₁₆H₁₄Cl₃N₃O₃Zr
• 分子量: 493.888
• InChiKey: MOYDXPNIVARQKL-UHFFFAOYSA-J

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：

  对硝基苯酚 以 甲苯 、 苯 为溶剂， 生成 ZrCl3(para-nitrophenoxide)(pyridine)2
  参考文献：
  名称：

  Synthesis and Characterization of para‐Nitrophenoxides of Zirconium(IV)

  摘要：

  Compounds of the composition ZrCl3(OC6H4NO2-p) and ZrCl2(OC6H4NO2-p)(2) have been synthesized from the reaction of ZrCl4 with equimolar and bimolar amounts of the trimethylsilyl derivative of p-nitrophenol in benzene under reflux. Attempts to isolate the tetrakis derivative, Zr(OC6H4NO2-p)(4), even by heating the components in high-boiling solvents were unsuccessful. Based upon analytical data, conductance, cryoscopic, IR and H-1 NMR studies, dimeric structures with bridging through phenoxo groups have been proposed for these compounds. The thermal decomposition of these complexes is a combination of both exothermic and endothermic processes, as is inferred from TG/DT studies. Reactions of these compounds with nitrogen bases viz., pyridine, 1,10-phenanthroline and 2,2'-bipyridyl results in breakdown of the bridged structure and formation of simple addition compounds, which have been assigned octahedral structures.

  DOI：

  10.1081/sim-120037525