bis(triphenylphosphine)iminium nitrito(phralocyaninato)zincate hydrate | 176677-55-7

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: bis(triphenylphosphine)iminium nitrito(phralocyaninato)zincate hydrate
• CAS: 176677-55-7
• 化学式: C₃₂H₁₆N₉O₂Zn*C₃₆H₃₀NP₂*H₂O
• 分子量: 1180.53
• InChiKey: UZBONGQTKUBDFP-UHFFFAOYSA-M

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：

  酞菁锌 、 二(三苯基膦烯)亚硝酸铵 以 丙酮 为溶剂， 生成 bis(triphenylphosphine)iminium nitrito(phralocyaninato)zincate hydrate
  参考文献：
  名称：

  Bis(triphenylphosphine)iminium Nitrito(phthalocyaninato)zincate Hydrate

  摘要：

  (b)(PNP)[Zn(ONO)Pc(2-)].H2O [Pc(2-) = (C32H16N8)(2-)] has been prepared from zinc phthalocyanine and bis-(triphenylphosphine)iminium nitrite [(PNP)NO2] in acetone. The Zn atom has tetragonal pyramidal coordination geometry with the Zn atom displaced out of the center (Ct) of the four inner N atoms (N-iso) of the non-planar Pc ligand toward the nitrite ligand [Zn--Ct = 0.469 (3) Angstrom]. The nitrite ion is monodentate O-coordinate [Zn--O = 2.059 (3) Angstrom]. The average Zn--N-iso distance is 2.032 Angstrom. Pairs of weakly overlapping anions are present. The cation adopts a bent conformation [(b)(PNP): P1--N(K) = 1.576 (2), P2--N(K) = 1.582 (2) Angstrom; P1--M(K)--P2 = 141.12 (13)degrees].

  DOI：

  10.1107/s0108270195014351