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[PtMe(CH(CO2Me)2)(2,9-dimethyl-1,10-phenanthroline)(methyl acrylate)] | 198965-78-5

中文名称
——
中文别名
——
英文名称
[PtMe(CH(CO2Me)2)(2,9-dimethyl-1,10-phenanthroline)(methyl acrylate)]
英文别名
——
[PtMe(CH(CO2Me)2)(2,9-dimethyl-1,10-phenanthroline)(methyl acrylate)]化学式
CAS
198965-78-5;199061-43-3
化学式
C24H28N2O6Pt
mdl
——
分子量
635.576
InChiKey
NMXQCJYIQPPYTH-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:
    Molecular rearrangements in the formation of five-coordinate platinum(II) olefin complexes. Structural and mechanistic aspects
    摘要:
    The olefin addition reaction to square-planar complexes of the type [PtXMe(N-N)] (X=Cl,CH(CO2Me)(2), N-N=bidentate nitrogen ligand), to form trigonal bipyramidal complexes has been shown to occur in two successive steps. First, a five-coordinate species (A) is formed in which the axial positions are occupied by the methyl group and by one nitrogen atom. In most cases this subsequently rearranges to the more stable isomer (B), in which both axial positions are occupied by the anionic ligands. The structure of the type A complex [PtMe{CH(CO2Me)(2)} (E-NCCH=CHCN) (dmphen)] has been determined by an X-ray diffraction study (triclinic, space group (No. 2), a = 9.497(3), b = 10.884(4), c = 15.671(4) Angstrom,alpha = 75.62(3), beta = 78.47(2), gamma = 66.52(3)degrees, Z=2). For the first time the equatorial-axial coordination of the dmphen ligand has been unequivocally ascertained. The molecule reveals a significant tension due to the short contacts between the methyl groups. The electronic and steric factors affecting the relative stability of type A and B species are discussed, and a mechanism for the overall process is proposed. (C) 1997 Elsevier Science S.A.
    DOI:
    10.1016/s0020-1693(97)05672-7
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