{Ru(2,2'-bipyridyl)Cl3}n | 69141-04-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: {Ru(2,2'-bipyridyl)Cl3}n
• 英文别名: Ru(2,2'-bipyridine)Cl3；{Ru(bpy)Cl3}；trichloro(2,2'-bipyridine)ruthenium；RuCl3(2,2'-bipyridine)；Ru(2,2'-bipyridyl)Cl3；Ru(pby)Cl3；2-Pyridin-2-ylpyridine;trichlororuthenium
• CAS: 69141-04-4
• 化学式: C₁₀H₈Cl₃N₂Ru
• 分子量: 363.616
• InChiKey: USMWFSYCRYNWFC-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  4.21
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  25.8
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  {Ru(2,2'-bipyridyl)Cl3}n 在 triethylamine 、 AgNO₃ 作用下， 以 乙醇 为溶剂， 生成 [Ru(2,2'-bipyridine)(1-(2'-pyridylazo)-2-naphtol(1-))(pyridine)]ClO4
  参考文献：
  名称：

  1-(2′-Pyridylazo)-2-naphtholate complexes of ruthenium: Synthesis, characterization, and DNA binding properties

  摘要：

  Reaction of 1-(2'-pyridylazo)-2 -naphthol (Hpan) with [Ru(dmso)(4)Cl-2] (dmso=dimethylsulfoxide), [Ru(trpy)Cl-3] (trpy=2,2',2 ''-terpyridine), [Ru(bpy)Cl-3] (bpy=2,2'-bipyridine) and [Ru(PPh3)(3)Cl-2] in refluxing ethanol in the presence of a base (NEt3) affords, respectively, the [Ru(pan)(2)], [Ru(trpy)(pan)](+) (isolated as perchlorate salt), [Ru(bpy)(pan)Cl] and [Ru(PPh3)(2)(pan)Cl] complexes. Structures of these four complexes have been determined by X-ray crystallography. in each of these complexes, the pan ligand is coordinated to the metal center as a monoanionic tridentate N,N,O-donor. Reaction of the [Ru(bpy)(pan)Cl] complex with pyridine (py) and 4-picoline (pic) in the presence of silver ion has yielded the [Ru(bpy)(pan)(py)](+) and [Ru(bpy)(pan)(pic)](+) complexes (isolated as perchlorate salts), respectively. All the complexes are diamagnetic (low-spin d(6), S = 0) and show characteristic H-1 NMR signals and intense MLCT transitions in the visible region. Cyclic voltammetry on all the complexes shows a Ru(II)-Ru(III) oxidation on the positive side of SCE. Except in the [Ru(pan)(2)] complex, a second oxidative response has been observed in the other five complexes. Reductions of the coordinated ligands have also been observed on the negative side of SCE. The [Ru(trpy)(pan)]ClO4, [Ru(bpy)(pan)(py)]ClO4 and [Ru(bpy) (pan)(pic)]ClO4 complexes have been observed to bind to DNA, but they have not been able to cleave super-coiled DNA on UV irradiation. (c) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2008.05.023

文献信息

• Chemistry of ruthenium phenolates. Synthesis, characterization and redox properties of a group of salicylaldiminato complexes of ruthenium
  作者：Nimai Chand Pramanik、Samaresh Bhattacharya

  DOI：10.1016/s0277-5387(96)00416-0

  日期：1997.3

  perchlorate salts. These oxidized complexes are paramagnetic (low spin d5, S = 1/2) and show rhombic ESR spectra at 77 K. They show intense LMCT transitions in the visible region in acetonitrile solution, together with weak ligand-field transitions at lower energies. Chemical reduction of these ruthenium(III) complexes by hydrazine gives back the parent ruthenium(II) complexes.

  合成并表征了一组五种通式[Ru（bpy）（sal-R）2 ]（bby = 2、2'-联吡啶，sal-R =水杨醛亚胺酸阴离子）的配位体钌（II）配合物。络合物是抗磁性的（低自旋d 6，S = 0），并且在溶液的可见光区域表现出强烈的MLCT跃迁。在乙腈溶液中，它们均显示出相对于SCE在-0.3至0.04 V范围内的可逆钌（II）-钌（III）氧化，随后又发生在1.1至1.3 V范围内的另一种可逆钌（III）-钌（IV）氧化与SCE。这两个氧化的电势对sal-R配体中取代基R的性质敏感。与SCE相比，在-t-1.9 V附近也观察到了可逆的bpy降低。五个[茹三世（bpy）（sal-R）2 ] +配合物是通过碘分别氧化各自的钌（II）前体而合成的，并分离为高氯酸盐。这些氧化的络合物是顺磁性的（低自旋d 5，S = 1/2），在77 K时显示出菱形的ESR光谱。它们在乙腈溶液的可见光区域显示出强
• Chemistry of 2-(arylazo)phenolate complexes of ruthenium. Synthesis, characterization and redox properties
  作者：Nimai Chand Pramanik、Samaresh Bhattacharya

  DOI：10.1016/s0277-5387(97)00028-4

  日期：1997.1

  salts. These oxidized complexes are one-electron paramagnetic low-spin, d5, S = 1 2 ) and show rhombic ESR spectra at 77 K. In acetonitrile solution they show intense LMCT transitions in the visible region together with weak ligand-field transitions at lower energies. Chemical reduction of these ruthenium(III) complexes by hydrazine gives back the parent ruthenium(II) complexes.

  摘要合成并表征了五种钌类型[RuII（bpy）（ap-R）2]（bpy = 2,2'-bipyridine）的2-（芳基偶氮）酚盐（ap-R）配合物。络合物是抗磁性的（低旋转d6，S = 0），在乙腈溶液中在可见光区显示出很强的MLCT跃迁。乙腈溶液中复合物的循环伏安法显示，相对于SCE，钌（II）-钌（III）的可逆氧化范围为0.04-0.26 V，然后钌酸（III）-钌（IV）的不可逆氧化范围为1.18-1.32 V vs SCE。这两种氧化的电势对apR配体中取代基R的性质敏感。与SCE相比，在-1.6 V附近也观察到配位bpy的单电子降低。五个[RuIII（bpy）（ap-R）2] +配合物是通过碘将其各自的钌（II）前体化学氧化而合成的，并分离为碘化物盐。这些氧化的络合物是单电子顺磁低自旋，d5，S = 1 2），在77 K时显示菱形ESR光谱。在乙腈溶液中，它们在可见光区域显示
• Bis(amido)ruthenium(IV) Complexes with 2,3-Diamino-2,3-dimethylbutane. Crystal Structure and Reversible Ru(IV)−Amide/Ru(III)−Amine and Ru(IV)−Amide/Ru(II)− Amine Redox Couples in Aqueous Solution
  作者：Wing-Hong Chiu、Shie-Ming Peng、Chi-Ming Che

  DOI：10.1021/ic951145n

  日期：1996.1.1

  bis(amido)ruthenium(IV) complexes, [Ru(IV)(bpy)(L-H)(2)](2+) and [Ru(IV)(L)(L-H)(2)](2+) (bpy = 2,2'-bipyridine, L = 2,3-diamino-2,3-dimethylbutane, L-H = (H(2)NCMe(2)CMe(2)NH)(-)), were prepared by chemical oxidation of [Ru(II)(bpy)(L)(2)](2+) and the reaction of [(n-Bu)(4)N][Ru(VI)NCl(4)] with L, respectively. The structures of [Ru(bpy)(L-H)(2)][ZnBr(4)].CH(3)CN and [Ru(L)(L-H)(2)]Cl(2).2H(2)O were determined

  两个双（氨基）钌（IV）络合物，[Ru（IV）（bpy）（LH）（2）]（2+）和[Ru（IV）（L）（LH）（2）]（2+） （bpy = 2,2'-联吡啶，L = 2,3-二氨基-2,3-二甲基丁烷，LH =（H（2）NCMe（2）CMe（2）NH）（-））是通过化学方法制备的[Ru（II）（bpy）（L）（2）]（2+）的氧化和[（n-Bu）（4）N] [Ru（VI）NCl（4）]与L的反应。[Ru（bpy）（LH）（2）] [ZnBr（4）]。CH（3）CN和[Ru（L）（LH）（2）] Cl（2）.2H（2）O的结构通过X射线晶体分析确定。[Ru（bpy）（LH）（2）] [ZnBr（4）]。CH（3）CN在单斜空间群P2（1）/ n中结晶，a = 12.597（2）Å，b = 15.909（2） ）Å，c = 16.785（2）Å，β= 91.74（1）度，Z =4。[Ru（L）（LH）（2）]
• Ruthenium complexes of quinone related N-aryl-1,2-diimines. Metal mediated synthesis, X-ray structure and chemical reactionElectronic supplementary information (ESI) available: partial energy level diagram and molecular orbitals of 1c. See http://www.rsc.org/suppdata/nj/b2/b203956g/
  作者：Chayan Das、Kunal K. Kamar、Amit K. Ghosh、Partha Majumdar、Chen-Hsuing Hung、Sreebrata Goswami

  DOI：10.1039/b203956g

  日期：2002.9.23

  consistent with a diimine oxidation state of the ligand bound to ruthenium in its bivalent oxidation state. These complexes showed multiple transitions in the near-IR and visible regions. The highly intense transition at around 540 nm has been assigned to a transition involving two heavily mixed metal–ligand orbitals. The ruthenium(III)/ruthenium(II) couple for the dihalo complexes appeared at a high anodic

  钌N-芳基-1,2-二亚氨基芳烃螯合物，[RuCl 2（bpy）（diim）]，1 （py=2,2'-联吡啶，[diim = N-芳基-1,2-二亚氨基芳烃]从[RuCl 3（bpy）]与伯芳香胺（ArNH 2）在空气中存在氧气。暗淡配体由于ArNH 2的氧化二聚反应原位形成。在该反应中，金属络合物充当介体。根据其理化数据对二氯配合物进行表征。确定了该家族一个成员的X射线结构，并将该结果用于验证芳香族化合物不寻常的氧化融合产物的形成一元胺。1c的X射线结构 （芳环上的取代基R = Cl）显示出相对于两种配位氯化物的顺式几何形状。螯合物以及芳环内的键长趋势与二亚胺 的氧化态 配体 以二价键结合到钌 氧化作用状态。这些复合物在近红外区和可见光区显示出多次跃迁。在大约540 nm处的高度跃迁被指定为涉及两种高度混合的金属的跃迁–配体轨道。钌（III）/钌（II）耦合用于以高阳极电势出现（范围0.50-0
• Synthesis, characterization, DNA binding and catalytic activities of Ru(III) complexes
  作者：A.Z. El-Sonbati、A.F. Shoair、A.A. El-Bindary、M.A. Diab、A.S. Mohamed

  DOI：10.1016/j.molliq.2015.06.019

  日期：2015.9

  the rhodanine moiety, thereby forming a six-membered chelating ring and concomitant formation of an intramolecular hydrogen bond. The molecular and electronic structures of the ligands (HLn) were also studied using quantum chemical calculations. The calf thymus DNA binding activity of the ligands (HLn) was studied by absorption spectra measurements. The Ru(III) complexes were tested as a catalysts for

  通过3-氨基磺酰基苯基若丹宁与苯胺及其对位偶合反应，合成了一系列新的偶氮染料配体4-（4-羟基-5-（芳基二氮烯基）-2-硫代噻唑-3（2H）-基）苯磺酰胺（HL n）-衍生物。这些配体及其反式-[Ru（L n）2（bipy）] Cl类型的Ru（III）络合物通过元素分析，IR，1 H NMR和UV-可见光谱以及磁和热测量进行表征。摩尔电导率测量证明所有络合物都是电解质。红外光谱表明，配体（HL n）通过偶氮基团的氮原子配位而作为一元二齿配体（NN-）和若丹宁部分去质子化的OH基团的氧原子，从而形成六元螯合环并伴随形成分子内氢键。还使用量子化学计算研究了配体（HL n）的分子和电子结构。通过吸收光谱测量研究了配体（HL n）的小牛胸腺DNA结合活性。在室温下，以N-甲基吗啉-N-氧化物作为助氧化剂，测试了Ru（III）配合物作为催化剂将苄胺脱氢为苄腈的方法。