lithium bis(4-tert-butylphenyl)-2-pyridylmethanethiolate | 143398-09-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: lithium bis(4-tert-butylphenyl)-2-pyridylmethanethiolate
• 英文别名: lithium bis(4-tert-butylphenyl)-2-pyridylmethanethiolate(1-)；Li(bis(4-tert-butylphenyl)-2-pyridylmethanethiolate)；Lithium;bis(4-tert-butylphenyl)-pyridin-2-ylmethanethiolate；lithium;bis(4-tert-butylphenyl)-pyridin-2-ylmethanethiolate
• CAS: 143398-09-8
• 化学式: C₂₆H₃₀NS*Li
• 分子量: 395.538
• InChiKey: HFKYCTRCOVSOSB-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  3.52
• 重原子数：
  29
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  13.9
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  lithium bis(4-tert-butylphenyl)-2-pyridylmethanethiolate 以 四氢呋喃 、 氘代苯 为溶剂， 生成 Rh[bis(4-tert-butylphenyl)-2-pyridylmethanethiolate(1-)](CO)2
  参考文献：
  名称：

  Syntheses and electrochemistry of metal complexes of a bulky pyridine-thiolate ligand

  摘要：

  Reactions of Li(tBuL-NS) (lithium bis(4-t-butylphenyl)-2-pyridylmethanthiolate(1-)) with MCl2 (M = Ni, Zn, Pt) afforded the respective M(tBuL-NS)(2) complexes in good yields. Treatment of CuCl2, Cu(OTf)(2) (OTf = triflate) and PdCl2(PhCN)(2) with Li(tBuL-NS) led to the formation of the dimeric compounds [Cu(tBuL-NS)Cl](2) . 2H(2)O, Cu-2(tBuL-NS)(3)(OTf) and [Pd(tBuL-NS)Cl](2), respectively. The interaction df Li-(t-BuL-NS) with [Ru(CO)(2)Cl-2](n), [Rh(COD)Cl](2) (COD = 1,5-cyclooctadiene) and Re(CO)(5)Cl gave cis-Ru(tBuL-NS)(2)(CO)(2), Rh(tBuL-NS)(COD) and Re(tBuL-NS)(CO)(4), respectively. The structure of Rh(tBuL-NS)(COD) has been established by X-ray crystallography. The geometry around Rh is square planar with Rh-N and Rh-S distances of 2.114 (5) and 2.250 (2) Angstrom, respectively. Reaction of Ni(PMe3)(2)(CH3)Cl with Li(tBuL-NS) afforded Ni(tBuL-NS)(PMe3)CH3, which undergoes CO insertion to give the acyl complex Ni(tBuL-NS) (PMe3)(COCH3). The cyclic voltammogram of Pt(tBuL-NS)(2) exhibits a reversible 1-electron couple al 0.3 V vs ferrocenium-ferrocene, which is assigned as the ligand-centered oxidation. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0277-5387(97)00098-3
• 作为产物：
  描述：

  叔丁基苯 在 正丁基锂 、 硫酸 作用下， 以 四氢呋喃 为溶剂， 生成 lithium bis(4-tert-butylphenyl)-2-pyridylmethanethiolate
  参考文献：
  名称：

  A broad-substrate analog reaction system of the molybdenum oxotransferases

  摘要：

  DOI：

  10.1021/ja00043a059

文献信息

• Synthesis, structure and oxo-transfer properties of dioxotungsten(VI) complexes with pyridine-based NO-and NS-bidentate ligands
  作者：Yee-Lok Wong、Qingchuan Yang、Zhong-Yuan Zhou、Hung Kay Lee、Thomas C. W. Mak、Dennis K. P. Ng

  DOI：10.1039/b006979p

  日期：——

  2-pyridylalkoxo NO-bidentate ligands [HLn (n  = 1–5)] in the presence of n-BuLi or 2-pyridylthiolato NS-bidentate ligands [LiLn (n  = 6, 7)] gave the corresponding dioxotungsten(VI) complexes [WO2(Ln)2] (n  = 1–7). The new compounds were spectroscopically characterised and the molecular structures of [WO2(Ln)2] (n  = 3–5) were also determined by X-ray diffraction analysis. While the complexes [WO2(Ln)2] (n  = 4

  的治疗[WO 2氯2（DME）]与2- pyridylalkoxo NO -bidentate配体[HL Ñ（Ñ  = 1-5）]在存在Ñ正丁基锂或2- pyridylthiolato NS -bidentate配体[律Ñ（Ñ  = 6，7）]给出了相应的二氧杂钨（VI）配合物[WO 2（L n）2 ]（n  = 1–7）。对新化合物进行了光谱表征和[WO 2（L n）2 ]（n的分子结构。  = 3–5）也通过X射线衍射分析确定。尽管配合物[WO 2（L n）2 ]（n  = 4、5）采用具有顺式-二氧代配体的正常扭曲的八面体几何形状，但[WO 2（L 3）2 ]中的金属中心表现出不寻常的二阶四面体配位，这可能是由于烷氧基配体的强σ供体能力引起的。这些高价的二氧杂配合物，特别是[WO 2（L 7）2 ]，其含有两个含硫的配体，对氧原子转移反应具有活性并且可以催化用DMSO的安息香的氧化。
• Synthesis and structural characterization of two tungsten(VI) dioxo complexes with N,O- and N,S-coordinating ligands
  作者：Anders Thapper、Olivier Balmes、Christian Lorber、Per H Svensson、R.H Holm、Ebbe Nordlander

  DOI：10.1016/s0020-1693(01)00509-6

  日期：2001.9
• Schultz, Brian E.; Gheller, Stephen F.; Muetterties, Mark C., Journal of the American Chemical Society, 1993, vol. 115, # 7, p. 2714 - 2722
  作者：Schultz, Brian E.、Gheller, Stephen F.、Muetterties, Mark C.、Scott, Michael J.、Holm

  DOI：——

  日期：——