bis(4-nitro-N,N'-disalicylidene-1,2-phenylenediaminato)zirconium(IV) | 111291-34-0

• 分子结构分类: 有机化合物 - 有机1,3-偶极化合物 - 烯丙基型1,3-偶极有机化合物
• 英文名称: bis(4-nitro-N,N'-disalicylidene-1,2-phenylenediaminato)zirconium(IV)
• 英文别名: [Zr(ndsp)2]；bis[4-nitro-N,N'-di(2-hydroxybenzylidene)-1,2-phenylenediaminato]zirconium(IV)
• CAS: 111291-34-0
• 化学式: C₄₀H₂₆N₆O₈Zr
• 分子量: 809.906
• InChiKey: FQPMENDADUQWSM-FKNIVHDNSA-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

• 作为反应物：
  描述：

  bis(4-nitro-N,N'-disalicylidene-1,2-phenylenediaminato)zirconium(IV) 、 氢气 在 catalyst: Pd/C 作用下， 以 四氢呋喃 为溶剂， 以82.2%的产率得到bis(4-amino-N,N'-disalicylidene-1,2-phenylenediaminato)zirconium(IV)
  参考文献：
  名称：

  Illingsworth, Marvin L.; Rheingold, Arnold L., Inorganic Chemistry, 1987, vol. 26, # 26, p. 4312 - 4318

  摘要：

  DOI：
• 作为产物：
  描述：

  4-硝基-N,N'-双(水杨醛)-1,2-苯二胺 、 tetra(n-butoxy)zirconium(IV) n-butanol solvate 以 乙醇 为溶剂， 以97%的产率得到bis(4-nitro-N,N'-disalicylidene-1,2-phenylenediaminato)zirconium(IV)
  参考文献：
  名称：

  Illingsworth, Marvin L.; Rheingold, Arnold L., Inorganic Chemistry, 1987, vol. 26, # 26, p. 4312 - 4318

  摘要：

  DOI：

文献信息

• Functional Derivatives of [4‐Amino‐<i>N</i>,<i>N</i>′‐<i>bis</i>(2‐hydroxybenzidene)‐1,2‐phenylenediaminato][<i>N</i>,<i>N</i>′‐<i>bis</i>(2‐hydroxybenzidene)‐1,2‐phenylenediaminato]zirconium(IV), Zr(adsp)(Rdsp), for Use as Pendent Groups
  作者：Marvin L. Illingsworth、Wei Wang、Kenneth A. Hughes、John A. Terschak、Jonathan P. McCarney、Russell A. Stapleton、Shawn R. Wagner、Kari J. Trotter、Raymond E. Courtney、Russel A. Giacofei、Andrew J. Jensen、Marc S. Moisa、Todd A. Browning、Birgit E. Puchebner、Carla A. Theimer、Yang Chen

  DOI：10.1081/sim-120030443

  日期：2004.3

  The objective of this research was to prepare a variety of functional group derivatives of the eight-coordinate complex [4-amino-N,N'-bis(2-hydroxybenzidene)-1,2-phenytenediaminato] [N,N'-bis(2-hydroxybenzidene)-1,2-phenylenediaminato]zirconium(IV), Zr(adsp)(dsp), for use as pendent groups on polymers. The synthetic method involved reaction of the free ligands di-2-hydroxybenzylidene-4-nitro-N,N'-phenylenediamine [H-2(ndsp)] and a functional group derivative of di-2-hydroxybenzylidene-N,N'-phenylenediamine [H-2(Rdsp), R = methyl, 3-methoxy, 5-methoxy, cyano, pyridyl nitrogen, and 3-fluoro substituents] with zirconium tetra-n-butoxide in I : I : I mole ratio, followed by column separation on silica gel and hydrogenation of the nitro group to amino group using hydrogen gas over Pd/C catalyst. The order of the latter two steps was chosen to affect the best column separation. Elemental analyses, physical data, FT-IR, and NMR spectral data for six new Zr(adsp)(Rdsp) complexes are reported. Eleven new Zr(ndsp)(Rdsp) and related homoleptic complexes are also included to corroborate spectral assignments.