di-μ-chlorido-bis[dichloridobis(methylamido-κN)bis(methylamine-κN)titanium(IV)] | 1337983-22-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: di-μ-chlorido-bis[dichloridobis(methylamido-κN)bis(methylamine-κN)titanium(IV)]
• 英文别名: dimethylazanide;N-methylmethanamine;titanium(4+);hexachloride
• CAS: 1337983-22-8
• 化学式: C₈H₂₆Cl₆N₄Ti₂
• 分子量: 486.799
• InChiKey: DOZFAUPYLVTBIA-UHFFFAOYSA-H

计算性质

• 辛醇/水分配系数(LogP)：
  -17.07
• 重原子数：
  20
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  26.1
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  tetrakis(dimethylamido)titanium(IV) 、 三氯化砷 以 乙醚 为溶剂， 以93%的产率得到di-μ-chlorido-bis[dichloridobis(methylamido-κN)bis(methylamine-κN)titanium(IV)]
  参考文献：
  名称：

  Di-μ-chlorido-bis[dichloridobis(methylamido-κN)bis(methylamine-κN)titanium(IV)]

  摘要：

  The title compound, [Ti2Cl6(C2H6N)(2)(C2H7N)(2)], is a binuclear octahedral complex lying about an inversion centre. There are four different chloride environments, two terminal [Ti-Cl = 2.2847 (5) and 2.3371 (5) angstrom] and two bridging [Ti-Cl = 2.4414 (5) and 2.6759 (5) angstrom], with the Ti-Cl distances being strongly influenced by both the ligand trans to the chloride and whether or not the chloride anion is bridging between the two Ti-IV centres. The compound forms a two-dimensional network in the solid state, with weak intermolecular C-H center dot center dot center dot Cl interactions giving rise to a planar network in the (10 (2) over bar) plane.

  DOI：

  10.1107/s0108270111023353