[ReCl3(ethyl ((2-pyridylmethyl)(1-methylimidazol-2-yl)methyl)amino)acetate)] | 476173-71-4

• 英文名称: [ReCl3(ethyl ((2-pyridylmethyl)(1-methylimidazol-2-yl)methyl)amino)acetate)]
• CAS: 476173-71-4
• 化学式: C₁₅H₂₀Cl₃N₄O₂Re
• 分子量: 580.915
• InChiKey: ZHXABPNARAFYPT-UHFFFAOYSA-K

计算性质

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

反应信息

• 作为产物：
  描述：

  trans-[ReOCl3(PPh3)2] 、 ethyl [(2-pyridylmethyl)((1-methylimidazol-2-yl)methyl)amino]acetate 以 氯仿 为溶剂， 以56%的产率得到[ReCl3(ethyl ((2-pyridylmethyl)(1-methylimidazol-2-yl)methyl)amino)acetate)]
  参考文献：
  名称：

  {Re^IIICl₃} Core Complexes with Bifunctional Single Amino Acid Chelates

  摘要：

  The reactions of the Re(V) starting material [ReO(PPh3)(2)Cl-3] with ligands of the type XN(Y)Z [X = Y = 2-pyridylmethyl, Z = -CH2CO2Et ((LEt)-Et-1), -CH2CH2CO2Et ((LEt)-Et-2), -CH2CH2CH2CH2CH(NHCO2But)CO2H ((LH)-H-3); X = 2-pyridylmethyl, Y = 2-(1-methylimidazolyl)methyl, Z = -CH2CO2Et (L4Et)] yielded the Re(III) trichloride complexes of the type [ReCl3((LR)-R-n)]. The complexes are mononuclear, paramagnetic species with a facial geometry of the chloride ligands. The nitrogen donors of the tridentate (LR)-R-n ligands complete the distorted octahedral coordination spheres of the complexes. Crystal data: [ReCl3((LEt)-Et-1)] (1), monoclinic, C2/m, a = 16.088(3) Angstrom, b = 9.980(2) Angstrom, c = 12.829(2) Angstrom, beta = 91.384(3), Z= 4, D-calc, = 1.967 g/cm(-3); [ReCl3((LEt)-Et-4)] (4), monoclinic, C2/c, a = 22.880(1) Angstrom, b = 7.4926(4) A, c = 22.560(1) Angstrom, beta = 94.186(1)degrees, Z = 8, D-calc = 2.001 g/cm(-3).

  DOI：

  10.1021/ic020391d