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| 203864-59-9

中文名称
——
中文别名
——
英文名称
——
英文别名
——
化学式
CAS
203864-59-9
化学式
C20H32Cl2N2Ti
mdl
——
分子量
419.273
InChiKey
QGIYHFJCTAHMML-UHFFFAOYSA-L
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:
    tetrachlorobis(tetrahydrofuran)titanium(IV) 、 ((1-(dimethylamino)-1-methylethyl)cyclopentadienyl)lithium 以 乙醚 为溶剂, 以20%的产率得到
    参考文献:
    名称:
    Synthesis and structural features of [(C5H4CMe2NMe2)2TiCl], a bis(cyclopentadienyl)Ti(III) complex with internal dimethylamino coordination
    摘要:
    Treatment of 6-dimethylamino-6-methylfulvene (1) with methyllithium gave the [C5H4-CMe2-NMe2]Li product (2) that was characterized by X-ray diffraction. Compound 2 features an oligomeric chain structure with the [C5H4-CMe2-NMe2] unit serving as a bridging ligand using its Cp anion moiety and the -NMe2 donor functionality. Treatment of 2 with FeCl2 yielded the substituted ferrocene 3. The corresponding reaction of 2 with TiCl4(THF)(2) gave the titanocene complex (C5H4-CMe2-NMe2)(2)TiCl2 (4) that exhibits an ordinary bent metallocene structure in the solid state without involvement of the pendant -CMe2-NMe2 donor ligands. In contrast, the titanium(III) complex (C5H4-CMe2-NMe2)(2)TiCl (5), obtained from the reaction of 2 with TiCl3(THF)(3), has one of the two nitrogen donors strongly coordinated to the metal center. In the crystal, complex 5 thus attains a typical pseudotetrahedral Group 4 bent metallocene structure, as shown by an X-ray crystal structure analysis. (C) 2003 Elsevier Science B.V. All rights reserved.
    DOI:
    10.1016/s0022-328x(03)00221-3
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