[W(CO)(acetylacetonate)2(η2-EtN=CMe)]O3SCF3 | 1014698-23-7

• 英文名称: [W(CO)(acetylacetonate)2(η2-EtN=CMe)]O3SCF3
• CAS: 1014698-23-7
• 化学式: CF₃O₃S*C₁₅H₂₂NO₅W
• 分子量: 629.264
• InChiKey: CYYOBKOOUWEDSN-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  [W(CO)(acetylacetonate)2(η2-EtN=CMe)]O3SCF3 、 甲基溴化镁 以 四氢呋喃 、 乙醚 为溶剂， 以69%的产率得到[W(CO)(acetylacetonate)2(η2-EtN=CMe2)]
  参考文献：
  名称：

  Reduction of π-Bound Nitriles to π-Bound Imines in a Tungsten(II) Bis(acetylacetonate) Coordination Sphere

  摘要：

  Addition of MeOTf (OTf = CF3SO3) to complexes of the type W(CO)(acac)(2)(eta(2)-N=CR) (acac = acetylacetonate) [R = Ph (1a), Me (1b)] yields cationic iminoacyl triflate salts of the type [W(CO)(acac)2(17 mu(2)-MeN=CR)][OTf]. Complexes 2a and 2b undergo nucleophilic attack at the iminoacyl carbon with Na[HB(OMe)(3)] or MeMgBr to form neutral 772-imine complexes of the type W(CO)(acac)(2)[eta(2)- MeN=C(Nuc)R] [Nuc = H (3a, 3b), Me (4)]. Hydride addition to 2b results in W(CO)(acac)(2)(eta(2)- MeN=CHMe), 3b, a complex that exhibits interconversion of diastereomers at ambient temperature on the NMR time scale. X-ray structures of cationic iminoacyl complex 2a and neutral imine complex 4 confirm eta(2)-C=N bonding of both the iminoacyl and imine ligands.

  DOI：

  10.1021/om7009039
• 作为产物：
  描述：

  三氟甲烷磺酸乙酯 、 [W(CO)(acetylacetonate)2(η2-NCMe)] 以 二氯甲烷 为溶剂， 以79%的产率得到[W(CO)(acetylacetonate)2(η2-EtN=CMe)]O3SCF3
  参考文献：
  名称：

  Reduction of π-Bound Nitriles to π-Bound Imines in a Tungsten(II) Bis(acetylacetonate) Coordination Sphere

  摘要：

  Addition of MeOTf (OTf = CF3SO3) to complexes of the type W(CO)(acac)(2)(eta(2)-N=CR) (acac = acetylacetonate) [R = Ph (1a), Me (1b)] yields cationic iminoacyl triflate salts of the type [W(CO)(acac)2(17 mu(2)-MeN=CR)][OTf]. Complexes 2a and 2b undergo nucleophilic attack at the iminoacyl carbon with Na[HB(OMe)(3)] or MeMgBr to form neutral 772-imine complexes of the type W(CO)(acac)(2)[eta(2)- MeN=C(Nuc)R] [Nuc = H (3a, 3b), Me (4)]. Hydride addition to 2b results in W(CO)(acac)(2)(eta(2)- MeN=CHMe), 3b, a complex that exhibits interconversion of diastereomers at ambient temperature on the NMR time scale. X-ray structures of cationic iminoacyl complex 2a and neutral imine complex 4 confirm eta(2)-C=N bonding of both the iminoacyl and imine ligands.

  DOI：

  10.1021/om7009039