mer-[RuCl3(dimethylsulfoxide)(MeOH)2] | 318952-23-7

• 分子结构分类: 有机化合物 - 有机硫化合物 - 磺酰类
• 英文名称: mer-[RuCl3(dimethylsulfoxide)(MeOH)2]
• CAS: 318952-23-7
• 化学式: C₄H₁₄Cl₃O₃RuS
• 分子量: 349.648
• InChiKey: ANTLALQZVAMCCX-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：

  在 methanol 作用下， 以 甲醇 为溶剂， 生成 mer-[RuCl3(dimethylsulfoxide)(MeOH)2]
  参考文献：
  名称：

  Alessio, Enzo; Balducci, Gabriele; Calligaris, Mario, Inorganic Chemistry, 1991, vol. 30, # 4, p. 609 - 618

  摘要：

  DOI：

文献信息

• Analyzing Ru(III)–dmso and Ru(III)–dms motifs in compounds used in the synthesis of the antimetastatic agents
  作者：Queite A. de Paula、Roberto W. de A. Franco、Marcio B. Ribeiro、Javier Ellena、Eduardo E. Castellano、Otaciro R. Nascimento、Alzir A. Batista

  DOI：10.1016/j.molstruc.2008.03.001

  日期：2008.11

  The chemistry of Ru(III) complexes containing dmso as a ligand has become an interesting area in the cancer treatment field. Because of this, structural knowledge and chemistry of the moiety Ru(III)-dmso have become important to cancer research. The crystal structures of the compounds mer-[RuCl3(dms)(3)] (1) and mer-[RuCl3(dms)(2)(dmso)]:mer-[RuCl3(dms)(3)] (2) were determined by X-ray crystallography and a speciation of the presence of intramolecular hydrogen bond in these structures has been studied. Compound (1) crystallizes in the orthorhombic space group, Pna2(1); a = 16.591(8) angstrom, b = 8.724(2) angstrom. c = 10.547(3) angstrom; Z = 12 and (2) crystallizes in the space group, P2(1)/C: a = 11.9930(2) angstrom, b = 7.9390(2) angstrom, c = 15.8700(3) angstrom, beta = 93.266(1)degrees, Z = 2. From the X-ray structures solved in this work, were possible to suggest an interpretation for the broad lines observed in the EPR spectra of the Ru(III) compounds explored here. Also, the exchange interactions detected by EPR spectroscopy in solid state and in solution, confirm the presence of van der Waals interactions such as C-H center dot center dot center dot Cl in the compounds (1), (2) and (3). The use of techniques such as IR, UV-vis, H-1 NMR and EPR Spectroscopy and Cyclic Voltammetry were applied in this work to analyze the behavior of these metallocompounds. (c) 2008 Elsevier B.V. All rights reserved.