lithium (diphenylphosphanyl)methanolate | 365450-13-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: lithium (diphenylphosphanyl)methanolate
• CAS: 365450-13-1
• 化学式: C₁₃H₁₂OP*Li
• 分子量: 222.152
• InChiKey: HCFYTWFIDVVEQK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.56
• 重原子数：
  16.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  23.06
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  二氯二茂锆 、 lithium (diphenylphosphanyl)methanolate 以 四氢呋喃 为溶剂， 以93%的产率得到[Cp2Zr((diphenylphosphanyl)methanolato)2]
  参考文献：
  名称：

  Flexible Building Blocks for Transition Metal Early−Late Chemistry. Synthesis of Heterobimetallic Tetranuclear Metallomacrocycles

  摘要：

  The reaction of LiOCH2PPh2 with the metallocene compounds [Cp2MCl2] yields the metallodiphosphines [Cp2M(OCH2PPh2)(2)] (M = Ti (1), Zr (2)). Compound 2 has also been prepared by reaction of HOCH2PPh2 with [CP2ZrMe2], although the reaction with [Cp-2(tt)-ZrMe2] (Cp-tt = eta(5)-1,3-di-tert-butylcyclopentadienyl) stops at the complex [(Cp2ZrMe)-Zr-tt(OCH2-PPh2)] (3). The mononuclear late transition metal complexes containing (diphenylphosphanyl)-methanol ligands, cis-[M(cod)(Ph2PCH2OH)(2)]BF4 (M = Rh (4), Ir (5)) and cis-[Pt(p-tolyl)(2)(Ph2PCH2OH)(2)] (6), have been prepared by reaction of [M(cod)(NCCH3)(2)]BF4 and [Pt(mu-SEt2)(p-tolyl)(2)](2) with HOCH2PPh2. The reaction of the metallodiphosphines 1 and 2 with the compounds [M(diolef)(NCCH3)(2)]BF4 (M = Rh, Ir) afforded the tetranuclear d(0)-d(8) early-late heterobimetallic (ELHB) metallomacrocycles [Cp2M(OCH2PPh2)(2)Ir(cod)](2)(2+) (M = Zr (7), Ti (8)) and [Cp2Zr(mu-OCH2PPh2)(2)Rh(nbd)](2)(2+) (9). The crystal structures of the 16-membered metallomacrocycles 7 and 9 have been determined by X-ray diffraction and show a rhomboidal arrangement of the metal centers with a conformation that is largely determined on steric grounds.

  DOI：

  10.1021/om050644l

文献信息

• Metallatriphos complexes: synthesis and molecular structure of [TpZr(OCH2PPh2)3] (Tp=tris(pyrazolyl)hydroborate) and formation of the heterodinuclear complex [TpZr(μ-OCH2PPh2)3Mo(CO)3] with bridging phosphinoalkoxide ligands
  作者：Olaf Kühl、Steffen Blaurock、Joachim Sieler、Evamarie Hey-Hawkins

  DOI：10.1016/s0277-5387(01)00811-7

  日期：2001.7

  [TpZr(OCH2PPh2)(3)] (1) is obtained from [TpZrCl(3)] and LiOCH2PPh2 in THF. Complex 1 reacts with [Mo(CO)(3)(NCEt)(3)] to give the heterodinuclear complex [TpZr(mu -OCH2PPh2)(3)Mo(Co)(3)] (2). Complexes 1 and 2 were characterised spectroscopically. Crystal structure determinations were carried out on 1 and on HOCH2PPh2. The former showed that the lone pairs of the P atoms appear to be suited ideally for coordination to a second metal centre. (C) 2001 Elsevier Science Ltd. All rights reserved.