[Cr(1,5,9,13-tetraaza-4-(1',1'-dimethyl-ethyl)-2-(1'',1'',2'',2'',3'',3'',3''-heptafluoropropyl)-10,12-(dimethyl)-cyclohexadeca-1,4,9,12-tetraene)Cl2]Cl | 752205-34-8

• 英文名称: [Cr(1,5,9,13-tetraaza-4-(1',1'-dimethyl-ethyl)-2-(1'',1'',2'',2'',3'',3'',3''-heptafluoropropyl)-10,12-(dimethyl)-cyclohexadeca-1,4,9,12-tetraene)Cl2]Cl
• CAS: 752205-34-8
• 化学式: C₂₁H₃₁Cl₂CrF₇N₄*Cl
• 分子量: 630.848
• InChiKey: IAERDGHUYNIEOQ-JVSCYRPLSA-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：

  1,5,9,13-tetraaza-4-(1',1'-dimethyl-ethyl)-2-(1'',1'',2'',2'',3'',3'',3''-heptafluoropropyl)-10,12-(dimethyl)-cyclohexadeca-1,4,9,12-tetraene 、 三氯化铬 在 HCl 作用下， 以 甲醇 为溶剂， 以57%的产率得到[Cr(1,5,9,13-tetraaza-4-(1',1'-dimethyl-ethyl)-2-(1'',1'',2'',2'',3'',3'',3''-heptafluoropropyl)-10,12-(dimethyl)-cyclohexadeca-1,4,9,12-tetraene)Cl2]Cl
  参考文献：
  名称：

  Synthesis and Characterization of New Macrocycles Containing Pendant Groups

  摘要：

  The new ligands, 1,5,8,12-tetraaza-4-(1',1'-dimethylethyl)-2-(1",1",2", 2",3".3".3"-heptafluoropropyl)-9,11-(dimethyl)-cyclotetradeca-1,4,8,11-tetraene (L-1) and 2",3",3",3"-heptafluoropropyl)-10,12-(dimethyl)-cyclohexadeca-1,4,9,12-tetraene (L-2), have been prepared by the reaction of 1,1,2.2,3,3,3-heptafluoro-7,7-dimethyl-4,6-octanedione with ethylenediamine and acetyl acetone (L) and 1,1,2,2,3,3,3-heptafluoro-7,7-dimethyl-4,6-octanedione with 1.3-diaminopropane and acetylacetonc (L-2), respectively. Their complexes with Cr(III). Mn(II), Fe(III), Co(II), Ni(II), Cu(II), and Zn(11) ions have also been synthesized and characterized by elemental analyses, magnetic susceptibility Measurements, molar conductance measurements, IR, EPR, H-1 NMR, and UV-Visible spectra. The molar conductance values show that the complexes of Fe(III) and Cr(III) are I : I electrolytes, the Ni(H) and Cu(H) complexes are I : 2 electrolytes while those of Mn(II), Co(H), and Zn(II) appear to be non-ionic. An octahedral Structure has been proposed for all of these metal ions except for those of Cu(II) and Ni(II), which appear to be square-planar. The beta values indicate a considerable orbital overlap in the metal-ligand bond. All of the compounds have been tested against grain-positive bacteria of Staphylococcus aureus and gram-negative bacteria of Escherichia coli. The results show that these compounds inhibit the growth of bacteria.

  DOI：

  10.1081/sim-120028305