trans-{(benzothiazole-2-thiolato)carbonylbis(triphenylphosphine)rhodium} | 150724-84-8

• 英文名称: trans-{(benzothiazole-2-thiolato)carbonylbis(triphenylphosphine)rhodium}
• CAS: 150724-84-8
• 化学式: C₄₄H₃₄NOP₂RhS₂
• 分子量: 821.745
• InChiKey: FLRKUYJUZCMOJH-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
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• 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：
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反应信息

• 作为反应物：
  描述：

  四氟硼酸-二乙醚络合物 、 trans-{(benzothiazole-2-thiolato)carbonylbis(triphenylphosphine)rhodium} 以 乙醚 、 二氯甲烷 为溶剂， 以90%的产率得到
  参考文献：
  名称：

  Chemical evidence of polynuclear intermediates in a ligand redistribution equilibrium between dinuclear rhodium complexes. X-ray structure of [Rh2(μ-bzta)2(CO)3(PPh3)] (bzta = benzothiazole-2-thiolate)

  摘要：

  The monosubstituted dinuclear complex [Rh2(mu-bzta)2(CO)3(PPh3)] (3) has been isolated from the reaction of the tetracarbonyl complex [{Rh(mu-bzta)(CO)2)2] (1) with triphenylphosphine. The crystal structural analysis of 3 has confirmed this complex to be dinuclear. The two metal centres exhibit distorted square-planar coordination and are bridged by two bzta ligands in a cis,cis and head-to-tail arrangement. The added PPh3 group has been located trans to a S atom of the bridging ligand. In solution, complex 3 is in dynamic equilibrium with 1 and the disubstituted complex [{Rh(mu-bzta)(CO)(PPh3)}2] (2) as a result of a reorganization process. Scrambling experiments carried out with related 6-methylbenzothiazole-2-thiolate complexes suggest that polynuclear intermediates are responsible for the ligand-redistribution equilibrium. Addition of further triphenylphosphine to the equilibrium mixture gives 2 quantitatively. Complex 2 reacts with triphenylphosphine to give the mononuclear complex trans-[Rh(bzta)(CO)(PPh3)2] (8) in high yield, as a result of a bridge-splitting reaction.

  DOI：

  10.1016/0022-328x(93)80403-x
• 作为产物：
  描述：

  {bis(μ-benzothiazole-2-thiolato)tricarbonyl(triphenylphosphine)dirhodium} 在 P(C₆H₅)3 作用下， 以 二氯甲烷 为溶剂， 生成 trans-{(benzothiazole-2-thiolato)carbonylbis(triphenylphosphine)rhodium}
  参考文献：
  名称：

  Chemical evidence of polynuclear intermediates in a ligand redistribution equilibrium between dinuclear rhodium complexes. X-ray structure of [Rh2(μ-bzta)2(CO)3(PPh3)] (bzta = benzothiazole-2-thiolate)

  摘要：

  The monosubstituted dinuclear complex [Rh2(mu-bzta)2(CO)3(PPh3)] (3) has been isolated from the reaction of the tetracarbonyl complex [{Rh(mu-bzta)(CO)2)2] (1) with triphenylphosphine. The crystal structural analysis of 3 has confirmed this complex to be dinuclear. The two metal centres exhibit distorted square-planar coordination and are bridged by two bzta ligands in a cis,cis and head-to-tail arrangement. The added PPh3 group has been located trans to a S atom of the bridging ligand. In solution, complex 3 is in dynamic equilibrium with 1 and the disubstituted complex [{Rh(mu-bzta)(CO)(PPh3)}2] (2) as a result of a reorganization process. Scrambling experiments carried out with related 6-methylbenzothiazole-2-thiolate complexes suggest that polynuclear intermediates are responsible for the ligand-redistribution equilibrium. Addition of further triphenylphosphine to the equilibrium mixture gives 2 quantitatively. Complex 2 reacts with triphenylphosphine to give the mononuclear complex trans-[Rh(bzta)(CO)(PPh3)2] (8) in high yield, as a result of a bridge-splitting reaction.

  DOI：

  10.1016/0022-328x(93)80403-x