ruthenium(II) phthalocyanine | 27636-56-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: ruthenium(II) phthalocyanine
• 英文别名: ruthenium phthalocyanine；2,11,20,29,37,39-Hexaza-38,40-diazanidanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaene;ruthenium(2+)
• CAS: 27636-56-2
• 化学式: C₃₂H₁₆N₈Ru
• 分子量: 613.603
• InChiKey: NPRSUVZEBGHFLD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.12
• 重原子数：
  41
• 可旋转键数：
  0
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  76.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  ruthenium(II) phthalocyanine 以 四氢呋喃 为溶剂， 以>99的产率得到phthalocyaninatoruthenium(II)(thf)2
  参考文献：
  名称：

  Synthesis of 1-alkynyl(phthalocyaninato)iron(II) and -ruthenium(II) complexes

  摘要：

  The preparation of dilithium[trans-bis(3,3-dimethyl-1-butynyl)phthalocyaninato]iron(II) (IIIb) is described. For comparison dilithium(trans-bis(phenylethynyl)phthalocyaninato]iron(II) (IIIa) was also made. Several 1-alkynyl(phthalocyaninato)ruthenium(II) compounds (IVa,b), of the first such species are reported. The products were obtained in high yields and characterized spectroscopically. The frequencies of the IR absorptions due to the stretching vibration of the C=C bond are discussed.

  DOI：

  10.1016/0022-328x(93)80202-m
• 作为产物：
  描述：

  di(pyridine)phthalocyaninato(2-)ruthenium(II) 以 solid 为溶剂， 以65%的产率得到ruthenium(II) phthalocyanine
  参考文献：
  名称：

  Shaabani; Bahadoran; Safari, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 2001, vol. 40, # 2, p. 195 - 197

  摘要：

  DOI：

文献信息

• Production of reactive oxygen and nitrogen species by light irradiation of a nitrosyl phthalocyanine ruthenium complex as a strategy for cancer treatment
  作者：Tassiele A. Heinrich、Antonio Claudio Tedesco、Jon M. Fukuto、Roberto Santana da Silva

  DOI：10.1039/c3dt52217b

  日期：——

  Nitric oxide (NO) and reactive oxygen species originated from [Ru(pc)(pz)₂Ru(bpy)₂(NO)}₂](PF₆)₆(I) have been postulated to act synergistically against cancer cells. NO is released from (I) by the reduction process and singlet oxygen formation by light irradiation at 660 nm.

  一种名为[Ru(pc)(pz)₂Ru(bpy)₂(NO)}₂](PF₆)₆(I)的化合物中产生的一氧化氮（NO）和反应性氧化物被推测能够协同作用对抗癌细胞。NO通过还原过程从(I)中释放，660nm光照射产生单线态氧。
• Structural Investigations of Tetra- and Octasubstituted (Phthalocyanine)ruthenium Complexes by EXAFS Spectroscopy
  作者：Achim Weber、Teja S. Ertel、Ulrich Reinöhl、Helmut Bertagnolli、Meret Leuze、Michael Hees、Michael Hanack

  DOI：10.1002/1099-0682(200010)2000:10<2289::aid-ejic2289>3.0.co;2-r

  日期：2000.10

  To obtain more structural information of (phthalocyaninato)ruthenium compounds, an EXAFS investigation was carried out on amorphous tBu4PcRu (1), tBu4PcRu(3-Clpy)2 (2), PcRu(3-Fpy)2 (3) and (C5H11O)8PcRu(3-Clpy)2 (4). Structural models for the four compounds are deduced from the atomic distances determined around the metal centre. A dimeric structure was found for 1, while bisaxial arrangement of the

  为了获得（酞菁）钌化合物的更多结构信息，对无定形 tBu4PcRu (1)、tBu4PcRu(3-Clpy)2 (2)、PcRu(3-Fpy)2 (3) 和 (C5H11O) 进行了 EXAFS 研究8PcRu(3-Clpy)2 (4)。这四种化合物的结构模型是从金属中心周围确定的原子距离推导出来的。发现 1 为二聚体结构，而 2、3 和 4 显示了配体的双轴排列，并且还确定了结构参数。
• Ketimido Metallophthalocyanines: An Approach to Phthalocyanine-Supported Mononuclear High-Valent Ruthenium Complexes
  作者：Jie-Sheng Huang、Kwok-Ming Wong、Sharon Lai-Fung Chan、Ken Chi-Hang Tso、Tao Jiang、Chi-Ming Che

  DOI：10.1002/asia.201301109

  日期：2014.1

  generation of high‐valent metal complexes featuring MN bonds with multiple bonding characters. DFT and time‐dependent (TD)‐DFT calculations have been performed on the electronic structures and the UV/Vis absorption spectra of 1b and 2b, which provide support for the diamagnetic nature of 2b and reveal a significant barrier for rotation of the ketimido group about the RuN(ketimido) bond.

  A“金属-酮亚胺+的Ar1（OR）2 ”的方法已被开发用于制备金属- ketimido络合物，配体ketimido被发现稳定的高价金属酞菁（M  PC）配合物，例如钌（IV）的酞菁。二处理（酮亚胺）合钌（II）酞菁的[Ru II（PC）（HNCPh 2）2 ]（1A）和[钌II（PC）（HNQu）2 ]（图1B ; HNQu = Ñ苯基-1- ，4- benzoquinonediimine）与岛（OAC）2，得到双（ketimido）钌（IV）酞菁的[Ru IV（PC）（NCPh 2）2 ]（2A）和[Ru IV（Pc）（NQu）2 ]（2b）。的X射线晶体结构图1b和的[Ru II（PC）（PhNCHPh）2 ]（1C）表示的Ru  N（酮亚胺）的2.075（4）和2.115（3）距离a，分别。用酚处理后，配合物2a，2b容易还原为1a，1b。1 H NMR谱表明2a，2b是反
• The reduction of oxygen and hydrogen peroxide on dinuclear ruthenium phthalocyanine electrocatalytic surfaces
  作者：Mehrdad Ebadi、Christos Alexiou、A BP Lever

  DOI：10.1139/v01-031

  日期：2001.5.1

  The electrochemical properties of both mononuclear L₂Ru^IIPc and dinuclear [(THF)Rupc]₂ species are described. The former is dominated by ring oxidation and reduction processes while the latter displays a series of metal localized processes. A Pourbaix diagram describes the various surfaces which can be generated by exposing a graphite electrode modified with [(THF)Rupc]₂ to aqueous buffer at different polarization over a wide range of pH. The behavior of these various surfaces towards the electrocatalytic reduction of both oxygen and hydrogen peroxide is described. Most importantly, three different regimes of hydrogen peroxide reduction are observed dependent on the nature of the modified electrode surface. At high pH the four electron reduction of oxygen to water is observed via a 2 + 2 mechanism.Key words: phthalocyanine, ruthenium, ruthenium phthalocyanine, cyclic voltammetry, suface modified electrode, Pourbaix diagram, electrocatalysis, oxygen reduction, hydrogen peroxide reduction.

  描述了单核L2RuII Pc和双核[(THF)Rupc]2物种的电化学性质。前者主要由环氧化和还原过程主导，而后者显示一系列金属局部化过程。Pourbaix图描述了在不同pH范围内以不同极化暴露于水溶液缓冲液的石墨电极上可以生成的各种表面。描述了这些不同表面对于氧和过氧化氢的电催化还原的行为。最重要的是，观察到了三种不同的过氧化氢还原机制，取决于修饰电极表面的性质。在高pH下，通过2 + 2机制观察到将氧气还原为水的四电子还原。关键词：酞菁，钌，钌酞菁，循环伏安法，表面修饰电极，Pourbaix图，电催化，氧还原，过氧化氢还原。
• The nature of the oxidation products of dicyanoruthenium phthalocyanine in aqueous and non-aqueous solvents
  作者：Tebello Nyokong

  DOI：10.1016/s0277-5387(00)81741-6

  日期：1993.2

  The cyclic voltammetry of [(CN)2RuIIPc]2− in acetonitrile or dichloromethane shows two oxidation couples at E = 0.31 and 0.85 V (vs S.C.E.) in CH2Cl2 and E = 0.45 and 1.15 V (vs S.C.E.) in acetonitrile. The spectroelectrochemistry of [(CN)2RuIIPc]2− in these solvents showed that oxidations occur at the phthalocyanine ligand. K2[(CN)2RuIIPc] dissolves in water at pHs greater than 5. The cyclic voltammetry

  [（CN）2 Ru II Pc] 2-在乙腈或二氯甲烷中的循环伏安法显示，CH 2 Cl 2中的E = 0.31和0.85 V（vs SCE），E = 0.45和1.15 V（vs SCE）有两个氧化对在乙腈中。在这些溶剂中的[（CN）2 Ru II Pc] 2-的光谱电化学表明，在酞菁配体上发生了氧化。K 2 [（CN）2 Ru II[Pc]溶于pH大于5的水中。该络合物的伏安法显示，分别对于含硫酸钠（0.1M）的水溶液和缓冲溶液（pH = 9），在0.32和0.29 V（vs SCE）下有氧化偶。循环伏安法和可控电库仑法都提供了氧化产物电结晶的证据。在水中的[（CN）2 Ru II Pc] 2-的化学氧化也显示了酞菁配体的氧化。