Ru2Cl(N,N'-bis(3,5-dichlorophenyl)formamidinato)3(MeNC(C6H4CHCHSiMe3)NMe)

• 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: Ru2Cl(N,N'-bis(3,5-dichlorophenyl)formamidinato)3(MeNC(C6H4CHCHSiMe3)NMe)
• 英文别名: (3,5-dichlorophenyl)-[(3,5-dichlorophenyl)iminomethyl]azanide;methyl-[N-methyl-C-[4-[(E)-2-trimethylsilylethenyl]phenyl]carbonimidoyl]azanide;ruthenium(2+);ruthenium(3+);chloride
• 化学式: C₅₃H₄₂Cl₁₃N₈Ru₂Si
• 分子量: 1482.08
• InChiKey: XYWQLXLNJZNQBU-QQXANGDKSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  24.64
• 重原子数：
  77
• 可旋转键数：
  13
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  53.4
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  Ru2Cl(N,N'-bis(3,5-dichlorophenyl)formamidinato)3(MeNC(C6H4CHCHSiMe3)NMe) 、 lithium phenylacetylide 以 not given 为溶剂， 生成 Ru2(C2Ph)2(N,N'-bis(3,5-dichlorophenyl)formamidinato)3(MeNC(C6H4CHCHSiMe3)NMe)
  参考文献：
  名称：

  Peripheral Functionalization of Diruthenium Compounds via Heck Reactions

  摘要：

  The coordination compounds RU2Cl(L)(3)(L'), where L is D(3,5-Cl2Ph)F and L' is either D(4-IPh)F or DMBA-I, underwent Heck cross-coupling reactions with terminal olefins to afford compounds 1 and 2; the organometallic compound trans-(PhC C)(2)Ru-2(L)(3)(DMBA-I) also underwent the Heck reaction under different conditions to yield compounds 3. Structural and voltammetric data indicated that the addition of peripheral olefins resulted in a minimal perturbation in both the coordination geometry around the Ru-2 center and the electronic properties of the Ru-2 species.

  DOI：

  10.1021/om7005408
• 作为产物：
  描述：

  chlorotris(N,N'-bis(3,5-dichlorophenyl)formamidinato)(N,N'-dimethyl-4-iodobenzamidinato)diruthenium 、 乙烯基三甲基硅烷 在 palladium diacetate n-Bu₄N(OC(O)CH₃) 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以78%的产率得到Ru2Cl(N,N'-bis(3,5-dichlorophenyl)formamidinato)3(MeNC(C6H4CHCHSiMe3)NMe)
  参考文献：
  名称：

  Peripheral Functionalization of Diruthenium Compounds via Heck Reactions

  摘要：

  The coordination compounds RU2Cl(L)(3)(L'), where L is D(3,5-Cl2Ph)F and L' is either D(4-IPh)F or DMBA-I, underwent Heck cross-coupling reactions with terminal olefins to afford compounds 1 and 2; the organometallic compound trans-(PhC C)(2)Ru-2(L)(3)(DMBA-I) also underwent the Heck reaction under different conditions to yield compounds 3. Structural and voltammetric data indicated that the addition of peripheral olefins resulted in a minimal perturbation in both the coordination geometry around the Ru-2 center and the electronic properties of the Ru-2 species.

  DOI：

  10.1021/om7005408

文献信息

• Peripheral Functionalization of Diruthenium Compounds via Heck Reactions
  作者：Wei-Zhong Chen、Phillip E. Fanwick、Tong Ren

  DOI：10.1021/om7005408

  日期：2007.8.1

  The coordination compounds RU2Cl(L)(3)(L'), where L is D(3,5-Cl2Ph)F and L' is either D(4-IPh)F or DMBA-I, underwent Heck cross-coupling reactions with terminal olefins to afford compounds 1 and 2; the organometallic compound trans-(PhC C)(2)Ru-2(L)(3)(DMBA-I) also underwent the Heck reaction under different conditions to yield compounds 3. Structural and voltammetric data indicated that the addition of peripheral olefins resulted in a minimal perturbation in both the coordination geometry around the Ru-2 center and the electronic properties of the Ru-2 species.