[RuCl2(1,4-bis(diphenylphosphino)butane)]2(μ-1,4-bis(diphenylphosphino)butane)

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [RuCl2(1,4-bis(diphenylphosphino)butane)]2(μ-1,4-bis(diphenylphosphino)butane)
• 英文别名: Ru2Cl4(1,4-bis(diphenylphosphino)butane)3；Ru2Cl4(dppb)3；Ru2Cl4(1,4-bis(diphenylphosphanyl)butane)3
• 化学式: 3C₂₈H₂₈P₂*4Cl*2Ru
• 分子量: 1623.39
• InChiKey: KGBPYNUSAWSANV-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  3.03
• 重原子数：
  32.0
• 可旋转键数：
  9.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  0.0
• 氢给体数：
  0.0
• 氢受体数：
  0.0

反应信息

• 作为反应物：
  描述：

  [RuCl2(1,4-bis(diphenylphosphino)butane)]2(μ-1,4-bis(diphenylphosphino)butane) 、 氯 以 苯 为溶剂， 以90%的产率得到[RuCl(1,4-bis(diphenylphosphino)butane)]2(μ-Cl)3
  参考文献：
  名称：

  Synthesis and Characterization of [RuCl₃(P-P)(H₂O)] Complexes; P-P = Achiral or Chiral, Chelating Ditertiary Phosphine Ligands

  摘要：

  The reaction of the dinuclear [RuCl2(dppb)](2)(mu-dppb) (dppb = 1,4-bis(diphenylphosphino)butane) with Cl-2 in MeOH for similar to 30 min at room temperature gives the bright-red solid mer-RuCl3(dppb)(H2O) (1); Cl-2 treatment for similar to 10 min affords the red-brown, mixed valence complex [RuCl(dppb)](2)(mu-Cl)(3) (2). Controlled bulk coulometric reduction of 50% of the content of a CH2Cl2 solution of 1 also produces 2, formed by the reaction of 1 with "RuCl2(dppb)" produced in situ during the electrolysis. Complexes 1 and 2 were characterized by spectroscopic techniques [including electron spin resonance (ESR)], magnetic moments and cyclic voltammetry, and the structure of 1 was determined by X-ray diffraction. The structure shows that the aquo ligand forms hydrogen bonds with two cis-chlorine ligands of the neighboring molecule of the complex; this interaction gives rise to exchange coupling between two Ru(III) centers that is reflected in the ESR spectrum. A species 3 analogous to 1 has been obtained with the diop ligand [diop = (2R,3R)- or (2S,3S)-O-isopropylidene-2,3-dihydroxy-1,4-bis(diphenylphosphino)butane], on using RuCl2(diop)(PPh3) or [RuCl(diop)](2)(mu-Cl)(3) as precursors. The RuCl3(P-P)L complexes (P-P = dppb, diop; L = dimethyl sulfoxide, MeOH) are readily synthesized from 1 or 3.

  DOI：

  10.1021/ic990130c
• 作为产物：
  描述：

  trans-HRuCl[Ph2P(CH2)4PPh2]2 以 氘代氯仿 为溶剂， 生成 [RuCl2(1,4-bis(diphenylphosphino)butane)]2(μ-1,4-bis(diphenylphosphino)butane)
  参考文献：
  名称：

  Hydrido-ditertiary phosphine, -arsine, and -chiral phosphine complexes of ruthenium(II)

  摘要：

  DOI：

  10.1016/s0020-1693(00)91115-0

文献信息

• Chemistry of pyridinethiols and related ligands—4.1 Complexes of bis(pyridine-2-thiolato- or 1-oxopyridine-2-thione) ruthenium(II) with bis(diphenylphosphino)alkanes
  作者：Tarlok S. Lobana、Randhir Singh

  DOI：10.1016/0277-5387(94)00317-8

  日期：1995.4

  obtained by the reactions of (i) RuL n Cl 2 [ n = 2 for L ( m = 1, 3) or n = 1.5 for L ( m = 4)] with HA ligands in the presence of triethylamine, (ii) RuA 2 (PPh 3 ) 2 with L ( m = 2; triphos; HA = C 5 H 5 NS), or (iii) RuCl 2 (PPh 3 ) 3 with C 5 H 5 NOS and L ( m = 2; triphos) in the presence of triethylamine and characterized using analytical data, IR, far-IR, UV-vis, 1 H and 13 C NMR, and cyclic

  摘要一系列含有2（1H）-吡啶硫酮（C 5 H 5 NS）或1-羟基吡啶-2-硫酮（C 5 H 5 NOS）和双（二苯基膦基）烷烃的钌（II）混合配体配合物，Ph 2 P（CH 2）m PPh 2（m = 1-4）和三叔膦（Ph 2 PCH 2 CH 2）2 PPh（triphOS），化学计量：RuA 2 L（HA = C 5 H 5 NS或C已经制备了5 H 5 NOS； L ＝二或三叔膦。配合物是通过（i）RuL n Cl 2 [对于L（m = 1，3）等于n = 2或对于L（m = 4）而言n = 1.5）与HA配体在三乙胺存在下的反应获得的， ii）具有L（m = 2; triphOS; HA = C 5 H 5 NS）的RuA 2（PPh 3）2或（iii）具有C 5 H 5 NOS和L（m = 2的RuCl 2（PPh 3）3 ；在三乙胺存在下，用分析数据，IR，远红外，UV-vis，1
• Thiosemicarbazonates of Ruthenium(II): Crystal Structures of [Bis(triphenylphosphine)][bis(<i>N</i>-phenyl-pyridine-2-carbaldehyde Thiosemicarbazonato)]ruthenium(II) and [Bis(diphenylphosphino)butane][bis(salicylaldehyde Thiosemicarbazonato)]ruthenium(II)
  作者：Tarlok S. Lobana、Gagandeep Bawa、Ray J. Butcher、Chen W. Liu

  DOI：10.1002/zaac.200800380

  日期：2009.2

  Reaction of RuCl2(PPh3)3 with N-Phenyl-pyridine-2-carbaldehyde thiosemicarbazone (C5H4N–C2(H)=N3-N2H–C1(=S)N1HC6H5, Hpytsc-NPh) in presence of Et3N base led to loss of -N2H-proton and yielded the complex [Ru(pytsc-NPh)2(Ph3P)2] (1). Similar reactions of precursor RuCl2[(p-tolyl)3P]3 with a series of thiosemicarbazone ligands, viz. pyridine-2-carbaldehyde thiosemicarbazone (Hpytsc), salicylaldehyde

  RuCl2(PPh3)3 与 N-苯基-吡啶-2-甲醛缩氨基硫脲（C5H4N-C2(H)=N3-N2H-C1(=S)N1HC6H5，Hpytsc-NPh）在 Et3N 碱存在下的反应导致损失-N2H-质子并产生复合物 [Ru(pytsc-NPh)2(Ph3P)2] (1)。前体 RuCl2[(p-tolyl)3P]3 与一系列缩氨基硫脲配体的类似反应，即。吡啶-2-缩氨基硫脲 (Hpytsc)、水杨醛缩氨基硫脲 (H2stsc) 和苯甲醛缩氨基硫脲 (Hbtsc) 产生了复合物 [Ru(pytsc)2(p-tolyl)3P}2] (2), [Ru (Hstsc)2(p-tolyl)3P}]2(3) 和 [Ru(btsc)2(p-tolyl)3P}2](4) 分别。前体 Ru2Cl4(dppb)3 dppb = Ph2P–(CH2)4–PPh2} 与 H2stsc、Hbtsc、呋喃-2-缩氨基硫脲
• Ruthenium complexes containing tertiary phosphines and imidazole or 2,2′-bipyridine ligands
  作者：Alzir A. Batista、Edna A. Polato、Salete L. Queiroz、Otaciro R. Nascimento、Brian R. James、Steven J. Rettig

  DOI：10.1016/0020-1693(94)04309-j

  日期：1995.3

  Complexes RuCl3(PPh3)L2 (L = MeIm (1a, Im (1b)) and [RuCl2(PPh3)2(bipy)]Cl·4H2O (2) have been synthesized via the ruthenium(III) precursor RuCl3(PPh3)2 (DMA), and characterized, including an X-ray structural analysis for 1a (MeIm = N-methylimidazole, Im = imidazole, bipy = 2,2′-bipyridyl, and DMA = N, N′-dimethylacetamide). Crystals of 1a are monoclinic, space group P21/n, a = 10.5491(5), b = 20.4934(9)

  通过钌（III）前体RuCl3（PPh3）2合成了RuCl3（PPh3）L2（L = MeIm（1a，Im（1b））和[RuCL2（PPh3）2（bipy）] Cl·4H2O（2）的配合物（DMA），并进行了特征分析，包括1a的X射线结构分析（MeIm = N-甲基咪唑，Im =咪唑，bipy = 2,2'-联吡啶和DMA = N，N'-二甲基乙酰胺）。是单斜晶系，空间群P21 / n，a = 10.5491（5），b = 20.4934（9），c = 12.8285（4）A，β= 90.166（4）°，Z = 4。通过传统的重原子方法可解决氯化物和顺式甲基咪唑的构型，并通过全矩阵最小二乘法将I≥3σ（I）的3328次反射精制为R = 0.041和Rw = 0.042。 （PPh3）3前体，已制成钌（II）络合物RuCL2（PPh3）2L2和[RuCl（PPh3）L4] Cl（L = Im或MeIm），
• A biphosphinic ruthenium complex with potent anti-bacterial and anti-cancer activity
  作者：José Marcos da Silveira Carvalho、Andressa Hellen de Morais Batista、Nádia Accioly Pinto Nogueira、Alda Karine Medeiros Holanda、Jackson Rodrigues de Sousa、Dávila Zampieri、Maria Júlia Barbosa Bezerra、Francisco Stefânio Barreto、Manoel Odorico de Moraes、Alzir A. Batista、Ana Cláudia Silva Gondim、Tercio de F. Paulo、Luiz Gonzaga de França Lopes、Eduardo Henrique Silva Sousa

  DOI：10.1039/c7nj02943h

  日期：——

  prepare a new ruthenium complex containing CO, we prepared a cis-[RuCl(CO)(dppb)(dppz)]PF6 complex (dppb = 1,4-bis(diphenylphosphino)butane and dppz = dipyrido[3,2-a:2′,3′-c]phenazine), which was fully characterized along with DFT studies. This compound exhibited great thermal stability in phosphate buffer solution, but showed fast and efficient release of CO upon light irradiation, including blue LED

  基于金属的化合物已经成为改善我们的药物库的一种新颖策略。在这些化合物中，一氧化碳供体试剂主要被开发为金属络合物。这些化合物显示出令人兴奋的生物学活性，其中有很强的抗炎，抗生素和抗癌活性，尽管其中一些特性也可能与金属部分有关。为了制备一种新的含CO的钌配合物，我们制备了一种顺式-[RuCl（CO）（dppb）（dppz）] PF 6配合物（dppb = 1,4-双（二苯基膦基）丁烷，dppz =二吡啶基[3,2 -一个：2'，3'- ç] phenazine），并与DFT研究一起进行了充分表征。该化合物在磷酸盐缓冲溶液中显示出极大的热稳定性，但在光照射下，包括蓝色LED，显示出快速有效的CO释放。令人惊讶的是，尽管有dppz配体部分，DNA结合还是很弱，这表明空间效应阻止了嵌入结合。然而，该化合物在低微摩尔范围内显示出对金黄色葡萄球菌，表皮葡萄球菌和白色念珠菌的有希望的抗生素活性。但是，光辐
• Metal Derivatives of Heterocyclic-2-thiones: Crystal Structures of [Bis(diphenylphosphanyl)propane][bis(pyrimidine-2-thiolato)]ruthenium(II) and [Bis(diphenylphosphanyl)methane][bis(pyridine-2-thiolato)]ruthenium(II)
  作者：Tarlok S. Lobana、Parminderjit Kaur、Amanpreet Kaur、Ray J. Butcher

  DOI：10.1002/zaac.201100243

  日期：2012.1

  Ruthenium(II) Complexes containing pyrimidine-2-thiolate (pymS–) and bis(diphenylphosphanyl)alkanes [Ph2P–(CH2)m–PPh2, m = 1, dppm; m = 2, dppe; m = 3, dppp; m = 4, dppb] are described. Reactions of [RuCl2L2] (L = dppm, dppp) and [Ru2Cl4L3] (L = dppb) with pyrimidine-2-thione (pymSH) in 1:2 molar ratio in dry benzene in the presence of Et3N base yielded the [Ru(pymS)2L] complexes (pymS– = pyrimidine-2-thiolate;

  含有嘧啶-2-硫醇盐 (pymS–) 和双（二苯基膦酰基）烷烃的钌 (II) 配合物 [Ph2P–(CH2)m–PPh2, m = 1, dppm; m = 2, dppe; m = 3，dppp；m = 4, dppb] 进行了描述。[RuCL2L2] (L = dppm, dppp) 和 [Ru2Cl4L3] (L = dppb) 与嘧啶-2-硫酮 (pymSH) 以 1:2 摩尔比在无水苯中在 Et3N 碱存在下反应生成 [Ru( pymS)2L] 复合物（pymS– = 嘧啶-2-硫醇盐；L = dppm (1)；dppp (3)；dppb (4)）。络合物[Ru(pymS)2(dppe)](2)是通过[Ru(pymS)2(PPh3)2]与dppe的反应间接制备的。这些配合物使用分析数据、IR、1H、13C、31P NMR 光谱和 X 射线晶体学（配合物 3）表征。还描述了类似配合物