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1,1,1-triphenyl-N-(triphenyl-l5-phosphaneylidene)-l5-phosphaniminium hexaazidophosphate(V) | 1089734-59-7

中文名称
——
中文别名
——
英文名称
1,1,1-triphenyl-N-(triphenyl-l5-phosphaneylidene)-l5-phosphaniminium hexaazidophosphate(V)
英文别名
——
1,1,1-triphenyl-N-(triphenyl-l5-phosphaneylidene)-l5-phosphaniminium hexaazidophosphate(V)化学式
CAS
1089734-59-7
化学式
C36H30NP2*N18P
mdl
——
分子量
821.683
InChiKey
ZPSCSYJYFHPOGH-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    None
  • 重原子数:
    None
  • 可旋转键数:
    None
  • 环数:
    None
  • sp3杂化的碳原子比例:
    None
  • 拓扑面积:
    None
  • 氢给体数:
    None
  • 氢受体数:
    None

反应信息

  • 作为产物:
    描述:
    bis(triphenylphosphoranylidene)ammonium azide乙腈 为溶剂, 以76%的产率得到1,1,1-triphenyl-N-(triphenyl-l5-phosphaneylidene)-l5-phosphaniminium hexaazidophosphate(V)
    参考文献:
    名称:
    Experimental and Theoretical Characterization of the Hexaazidophosphate(V) Ion
    摘要:
    (PPN)[P(N(3))(6)] (2) was synthesized by the metathesis of Na[P(N(3))(6)] (1) and (PPN)N(3) (PPN(+) = {(Ph(3)P)(2)N}(+)), allowing for the isolation and full characterization of a stable hexaazidophosphate(V) salt by (31)P and (14)N NMR, UV absorption, IR and Raman spectroscopy, elemental and thermal analyses, X-ray diffraction, and Hartree-Fock and density functional theory calculations. The colorless single crystals of 2 are triclinic, space group P1, a = 9.6296(9), b = 9.8158(9), c = 10.1414(10) angstrom, alpha = 92.635(5)degrees, beta = 93.437(5)degrees, gamma = 92.105(4)degrees, and Z = 1. The [P(N(3))(6)](-) ion of 2 is isolated in the solid state and adopts S(6) symmetry both in the crystal and in solution. Thermogravimetric analysis and differential scanning calorimetry measurements reveal a surprising thermal stability of 2 (T(dec) ca. 200 degrees C). No friction sensitivity was encountered.
    DOI:
    10.1021/ic801536z
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