mer-[RuCl3(dmso-S)(phen)] | 118578-51-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 英文名称: mer-[RuCl3(dmso-S)(phen)]
• 英文别名: Methylsulfinylmethane;1,10-phenanthroline;trichlororuthenium
• CAS: 118578-51-1；119325-17-6
• 化学式: C₁₄H₁₄Cl₃N₂ORuS
• 分子量: 465.773
• InChiKey: GTOJEOYCPCKNJM-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  4.84
• 重原子数：
  22
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  62.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  mer-[RuCl3(dmso-S)(phen)] 、 水 在 盐酸 作用下， 反应 4.0h， 生成 (H3O)[RuCl4(phen)]*4H2O
  参考文献：
  名称：

  Turel, Iztok; Golobič, Amalija; Kljun, Jakob, Acta Chimica Slovenica, 2015, vol. 62, # 2

  摘要：

  DOI：
• 作为产物：
  描述：

  1,10-菲罗啉 、 alkaline earth salt of/the/ methylsulfuric acid 在 盐酸 作用下， 以 乙醇 、 水 为溶剂， 反应 2.0h， 以46%的产率得到mer-[RuCl3(dmso-S)(phen)]
  参考文献：
  名称：

  Roles of DMSO-type ruthenium complexes in disaggregation of prion neuropeptide PrP106–126

  摘要：

  DMSO型钌配合物与芳香配体通过金属配位和疏水作用使成熟的PrP106-126纤维解聚。

  DOI：

  10.1039/c5ra21523d

文献信息

• Complexes of Ruthenium(III) with dimethylsulphoxide—I. [Ru2Cl6(DMSO)4], fac and mer isomers of [RuCl3(DMSO)3]: Versatile starting materials for the synthesis of ruthenium(III) complexes
  作者：Uma Charan Sarma、K.P. Sarma、Raj K. Poddar

  DOI：10.1016/s0277-5387(00)80404-0

  日期：1988.1

  Abstract Ruthenium(III) complexes with dimethylsulphoxide (DMSO), [RuCl 3 (DMSO) 2 ] 2 and [RuCl 3 (DMSO) 3 ] were synthesized and characterized by physical methods. The fac and mer isomers of [RuCl 3 (DMSO) 3 ], were obtained. The fac isomer has all S-bonded DMSO whereas mer has both S- and O-bonded DMSO molecules. The above three compounds were reacted with S, P, As, N and O donor ligands leading

  摘要合成了钌（III）与二甲亚砜（DMSO），[RuCl 3（DMSO）2] 2和[RuCl 3（DMSO）3]的配合物，并通过物理方法对其进行了表征。获得了[RuCl 3（DMSO）3]的fac和mer异构体。fac异构体具有所有S键结合的DMSO，而mer具有S键和O键结合的DMSO分子。根据反应条件和引入配体的性质，使上述三种化合物与S，P，As，N和O供体配体反应，导致部分或完全取代DMSO分子。S，P和As供体配体可完全取代DMSO分子，而N和O供体配体通常可部分取代。制备并表征的新化合物为[RuCl 3 L 2（DMSO）]（其中L = py，CH 3 CN； L 2 = 1,10-菲咯啉，2,2'-联吡啶）和[Ru（acac）（DMSO） 2 Cl 2]。
• Ruthenium-Catalyzed Isomerization of Allylic Alcohols: Oxidation State Determines Resistance Against Diene Inhibition
  作者：Robert C. van der Drift、Jeroen W. Sprengers、Elisabeth Bouwman、Wilhelmus P. Mul、Huub Kooijman、Anthony L. Spek、Eite Drent

  DOI：10.1002/1099-0682(200208)2002:8<2147::aid-ejic2147>3.0.co;2-l

  日期：2002.8

  couples RuIII/II (0.11 V) and Ru IV/III (1.73 V). The analogous Ru II complex cis,cis-[RuCl2(dmso)2(phen)] (2) shows one reversible wave at 1.08 V, corresponding to the Ru III/II couple. Both complexes exhibit high catalytic activity in the isomerization of 3-buten-2-ol to butanone. The initial turnover frequency (TOF) for 1 in diglyme/water at 130 °C is 295 h −1 with a firstorder kini of 0.6 h −1 , while

  新的复合体-[RuCl3(dmso)(phen)] (1) 已制备并通过 X 射线衍射表征。钌中心位于扭曲的八面体环境中，三个氯离子以 mer 方式配位，S 键合的 dmso 配体与苯氮原子之一发生反式。电化学实验显示乙腈溶液中有两个可逆波，对应于 RuIII/II (0.11 V) 和 Ru IV/III (1.73 V) 对。类似的 Ru II 络合物 cis,cis-[RuCl2(dmso)2(phen)] (2) 在 1.08 V 处显示一个可逆波，对应于 Ru III/II 对。两种配合物在 3-buten-2-ol 异构化为丁酮中都表现出高催化活性。在 130 °C 下二甘醇二甲醚/水中 1 的初始转换频率 (TOF) 为 295 h -1 ，一阶 kini 为 0.6 h -1 ，而 2 达到初始 TOF 为 260 h -1 且 kini 为 0。5小时 -1 。以 1 作为催化剂前体获得了
• New synthetic routes for the preparation of ruthenium-1,10-phenanthroline complexes. Tests of cytotoxic and antibacterial activity of selected ruthenium complexes
  作者：Iztok Turel、Amalija Golobič、Jakob Kljun、Petra Samastur、Urška Batista、Kristina Sepčić

  DOI：10.17344/acsi.2014.1130

  日期：2015.6.15

  Three novel complexes have been prepared through reactions of precursor [(dmso)(2)H][trans-RuCl4(dmso-S)(2)] (P) and 1,10-phenanthroline (phen) at different conditions. Whereas the analogs of mer-[RuCl3(dmso-S)(phen)] (1) and [Ru(phen)(3)]Cl-2 center dot 6CH(3)OH(3 center dot 6CH(3)OH) have already been prepared by other synthetic routes before, product (H3O)[RuCl4(phen)(3)]center dot 4H(2)O (2 center dot 4H(2)O) is unprecedented. In the latter, isolated from highly acidic medium, also the second, strongly bound dmso molecule in precursor P was substituted by chloride. Biological activities of 1 and previously isolated ruthenium-purine complexes ([mer-RuCl3(dmso-S)(acv)(CH3OH)] (4) (acv = acyclovir); [trans-RuCl4(dmso-S)(guaH)] (5) (guaH = protonated guanine) were tested and compared. These data show that compounds 1, 4 and 5 are slightly cytotoxic against B-16 malignant melanoma cells but not against non-transformed V-79-379A cells. The results indicate that coordinated phen ligand increases the cytotoxicity of 1 in comparison to ruthenium precursor. The inability of tested compounds to induce lysis of bovine erythrocytes shows that their cytotoxic effect is not due to the membrane damage.