TiCl4(H2AstBu) | 1235967-08-4

• 英文名称: TiCl4(H2AstBu)
• CAS: 1235967-08-4
• 化学式: C₄H₁₁AsCl₄Ti
• 分子量: 323.745
• InChiKey: DBSABGYFQWHSCG-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  3.59
• 重原子数：
  10.0
• 可旋转键数：
  0.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为产物：
  描述：

  叔丁基胂 、 四氯化钛 生成 TiCl4(H2AstBu) 、 tert-butylarsenium(III) tri-μ-chlorido-bis[trichloridotitanium(IV)]
  参考文献：
  名称：

  Novel ion pairs obtained from the reaction of titanium(IV) halides with simple arsane ligands

  摘要：

  The compounds tert-butylarsenium(III) tri-mu-chlorido-bis[trichloridotitanium(IV)], (C4H12As)[Ti2Cl9] or [ t BuAsH3][Ti-2(mu-Cl)(3)Cl-6], (II), and bis[bromidotriphenylarsenium(V)] di-mu-bromido-mu-oxido-bis[tribromidotitanium(IV)], (C18H15AsBr)(2)[Ti2Br8O] or [Ph3AsBr](2)[Ti-2(mu-O)(mu-Br)(2)Br-6], (III), were obtained unexpectedly from the reaction of simple arsane ligands with TiIV halides, with (II) lying on a mirror plane in the unit cell of the space group Pbcm. Both compounds contain a completely novel ion, with [ t BuAsH3]+ constituting the first structurally characterized example of a primary arsenium cation. The oxide-bridged titanium-containing [Ti-2(mu-O)(mu-Br)(2)Br-6]2- dianion in (III) is also novel, while the bromidotriphenylarsenium(V) cation is structurally characterized for only the second time.

  DOI：

  10.1107/s0108270111006639

文献信息

• Syntheses, X-ray structures and CVD of titanium(iv) arsine complexes
  作者：Tegan Thomas、David Pugh、Ivan P. Parkin、Claire J. Carmalt

  DOI：10.1039/c001359e

  日期：——

  novel exchange between a Cl and an NMe2 group, yielding the product [TiCl3(NMe2)(μ-NMe2)2AsCl]. The crystal structure of [TiCl3(NMe2)(μ-NMe2)2AsCl] has been determined and showed that the titanium and arsenic atoms are linked via two bridging NMe2 groups. Additionally, crystal structures for the 1 : 1 and 1 : 2 adducts, [TiCl4(AsPh3)] and [TiCl4(AsPh3)2] have been obtained, with Ti–As bond lengths of

  五 钛a化合物是通过以下反应合成的的TiCl 4 和 AsPh 3（1：1和1：2当量），或Ph 2 AsCH 2 AsPh 2，t BuAsH 2和砷（NMe 2）3。通常，[类型的1：1和1：2加合物TiCl 4（L）n]（n = 1，L =AsPh 3，Ph 2 AsCH 2 AsPh 2和t BuAsH 2 ; n = 2，L =AsPh 3），进行了隔离和表征。但是，的TiCl 4 和 砷（NMe 2）3导致Cl和NMe 2基团之间发生了新颖的交换，从而产生了[的TiCl 3（NME 2）（μ-NME 2）2 AscI位]。[的晶体结构的TiCl 3（NME 2）（μ-NME 2）2 AscI位]已确定，并表明 钛 和 砷原子通过两个桥连接NMe 2组。此外，1：1和1：2加合物的晶体结构[TiCl 4（AsPh 3）] 和 [TiCl 4（AsPh 3）2，得到的Ti-As键长分别为2