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[Yb(tricyclohexylphosphine)3(NO3)3]*EtOH | 959755-75-0

中文名称
——
中文别名
——
英文名称
[Yb(tricyclohexylphosphine)3(NO3)3]*EtOH
英文别名
[Yb(Cy3PO)3(NO3)3]*EtOH
[Yb(tricyclohexylphosphine)3(NO3)3]*EtOH化学式
CAS
959755-75-0
化学式
C2H6O*C54H99N3O12P3Yb
mdl
——
分子量
1294.42
InChiKey
CZNRYOGGBAUNGI-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:
    参考文献:
    名称:
    Synthesis, structures and mass spectrometry of lanthanide nitrate complexes with tricyclohexylphosphine oxide
    摘要:
    The complexes Ln(NO3)(3)(OPCy3)(3)(EtOH)(x) (Cy = cyclohexyl, C6H11 x = 0 for Ln = Eu, Er, x = 0.5 for Ln = La, Nd and x = 1 for Ln = Tm, Yb) have been prepared by reaction of lanthanide nitrates with Cy3PO in ethanol. The single crystal X-ray structures for Ln = La, Nd, Eu, Er, Tm and Yb are reported. The structures for Ln = La-Eu have two molecules in the unit cell in which the nitrates are all bound as bidentate ligands. The unit cell for Ln = Er contains two distinct molecules; one with three bidentate nitrates and one with two bidentate and one monodentate nitrate. The Tm and Yb complexes have one molecule in the unit cell with two bidentate and one monodentate nitrate ligands. The monodentate nitrates are hydrogen bonded to ethanol in the Tm and Yb structures but not in the Er complex. The infrared spectra of the three classes of complex do not readily permit identification of the monodentate nitrate groups. Electrospray mass spectrometry indicates that redistribution/ionisation reactions occur in solution. Ions formed by solvolysis reactions are attributed to gas phase processes associated with the electrospray technique. Tandem mass spectrometry for the La, Ho and Yb complexes shows that in the gas phase loss Of Cy3PO is the sole fragmentation pathway for all but the Yb complex where the higher energy required for initial fragmentation leads to a more complex fragmentation pattern. (C) 2007 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.poly.2007.06.023
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