{(2-mercaptobenzothiazole)-copper(I)} | 4860-19-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻唑类
• 英文名称: {(2-mercaptobenzothiazole)-copper(I)}
• 英文别名: copper(I) 2-mercaptobenzothiazolate；copper(I) benzothiazole-2-thiolate；copper(I) benzthiazolyl-2-mercaptide；1,3-benzothiazole-2-thiolate;copper(1+)
• CAS: 4860-19-9
• 化学式: C₇H₄NS₂*Cu
• 分子量: 229.793
• InChiKey: OFEUSUWRXZHDRM-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  42.1
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  {(2-mercaptobenzothiazole)-copper(I)} 在 吡啶 、 水 作用下， 以 吡啶 为溶剂， 生成
  参考文献：
  名称：

  The production of the sulphate anion by interaction of thioamides with copper compounds in pyridine solvent

  摘要：

  DOI：

  10.1016/s0020-1693(00)87558-1
• 作为产物：
  描述：

  bis(2-mercaptobenzothiazolato)copper(II) 以 neat (no solvent) 为溶剂， 生成 {(2-mercaptobenzothiazole)-copper(I)}
  参考文献：
  名称：

  Feigl, F., Journal of Chemical Education, 1944, vol. 21, p. 294 - 298

  摘要：

  DOI：
• 作为试剂：
  描述：

  正辛基镁溴盐 、 2-hexa-2,4-dien-1-ylthiobenzothiazole 在 {(2-mercaptobenzothiazole)-copper(I)} 作用下， 生成 tetradeca-2,4-diene
  参考文献：
  名称：

  Calo, Vincenzo; Lopez Luigi; Carlucci, Walter, Journal of the Chemical Society. Perkin transactions I, 1983, # 12, p. 2953 - 2956

  摘要：

  DOI：

文献信息

• Acceptorless Dehydrogenation of Alcohols Catalyzed by Cu^I<i>N</i>-Heterocycle Thiolate Complexes
  作者：Da-Wei Tan、Hong-Xi Li、Meng-Juan Zhang、Jian-Lin Yao、Jian-Ping Lang

  DOI：10.1002/cctc.201601459

  日期：2017.3.20

  CuI N‐heterocycle thiolate clusters efficiently catalyze the acceptorless dehydrogenation of alcohols at 70 °C. A variety of secondary/primary benzylic, allylic, and aliphatic alcohols are dehydrogenated to the corresponding ketones and aldehydes in high yields of isolated product upon release of H2. This simple catalytic system is involved in the synthesis of imines through the one‐pot reaction of

  Cu I N杂环硫醇盐簇在70°C时有效催化醇的无受体脱氢。释放H 2时，可以以高收率的分离产物将各种仲/伯苄基，烯丙基和脂族醇脱氢成相应的酮和醛。这个简单的催化系统通过醇和胺的一锅法反应参与亚胺的合成。
• Convenient synthesis of copper (I) thiolates and related compounds
  作者：Lynda M. Nguyen、Megan E. Dellinger、Jeffrey T. Lee、Ronald A. Quinlan、Arnold L. Rheingold、Robert D. Pike

  DOI：10.1016/j.ica.2004.11.030

  日期：2005.3

  Copper (I) salts of various anions including thiolates, diethyl dithiocarbamate, diethyl dithiophosphate, trithiocyanurate, 1cyano-3-methylisothiourea, 2-aminothiazole, and tetrakis(1-imidazolyl)borate are conveniently synthesized by reducing copper (II) sulfate in aqueous ammonia. The addition of phosphine ligands to several of the products is demonstrated, and the crystal structure of [Cu2(MBT)2(DPPE)3]

  通过在氨水中还原硫酸铜（II）可以方便地合成各种阴离子的铜（I）盐，包括硫醇盐，二乙基二硫代氨基甲酸酯，二乙基二硫代磷酸酯，三硫氰尿酸酯，1-氰基-3-甲基异硫脲，2-氨基噻唑和四（1-咪唑基）硼酸酯。 。证明了将膦配体添加到几种产品中，并证明了[Cu2（MBT）2（DPPE）3] AE Et2O的晶体结构（MBT = 2-巯基苯并噻唑酸盐，DPPE = 1,2-双（二苯基膦基）乙烷）被报道。 2004 Elsevier BV保留所有权利。
• Regulating the near-infrared region to visible-light emission by adjusting cuprophilic interactions for blue light-excited phosphors
  作者：Guang-Ning Liu、Rang-Dong Xu、Jin-Shuang Guo、Jin-Ling Miao、Ming-Jian Zhang、Cuncheng Li

  DOI：10.1039/d1tc00964h

  日期：——

  bands of the copper(I) nanoclusters displayed stepwise blueshifts from the near-infrared region to visible red-light region, which could be ascribed to the cluster-centered phosphorescence emission. This is the first study to report the luminescence regulation of hexanuclear copper(I) nanoclusters by regulating cuprophilic interactions. The underlying mechanism was clearly revealed by precise structural

  发光铜（I）基团簇在固态照明领域引起了广泛关注。然而，通过精确的结构控制合理调节发光性能仍然是一个挑战。在此，通过调节有机配体设计了三种结构不同的六核铜（I）纳米团簇以揭示结构-光致发光关系。铜（I）纳米团簇的发射带显示出从近红外区域到可见红光区域的逐步蓝移，这可能归因于以团簇为中心的磷光发射。这是首次报道六核铜（I) 通过调节亲铜相互作用形成纳米团簇。通过精确的结构分析、稳态、瞬态和温度相关的发光测量以及理论计算，清楚地揭示了潜在的机制。重要的是，Cu 6 (BPT) 6 (BPT = 5- bromopyridine -2-thiolate, UJN-Cu4 ) 和 Cu 6 (TPT) 6 (TPT = 5-(trifluoromethyl)pyridine-2-thiolate, UJN-Cu5 ) 可以是有效地被蓝光激发，从而满足基于商用 460 nm 蓝光发光二极管 (LED)
• A survey on the effects of ultrasonic irradiation, reaction time and concentration of initial reagents on formation of kinetically or thermodynamically stable copper(I) metal-organic nanomaterials
  作者：Elham Mirzadeh、Kamran Akhbari、Anukorn Phuruangrat、Ferdinando Costantino

  DOI：10.1016/j.ultsonch.2016.10.016

  日期：2017.3

  In order to evaluation the effects of ultrasonic irradiations, concentration of initial reagents and reaction time on formation [Cu4(MBT)4] or [Cu6(MBT)6] copper(I) metal-organic nanomaterials, [HMBT=2-Mercaptobenzothiazole], we designed some experiments and synthesized six samples under different conditions. These nanostructures were characterized by IR spectroscopy, X-ray powder diffraction (XRD)

  为了评估超声辐射，初始试剂的浓度和反应时间对形成[Cu4（MBT）4]或[Cu6（MBT）6]铜（I）金属有机纳米材料[HMBT = 2-巯基苯并噻唑]的影响，我们设计了一些实验，并在不同条件下合成了六个样品。这些纳米结构通过红外光谱，X射线粉末衍射（XRD）和扫描电子显微镜（SEM）进行表征。似乎[Cu4（MBT）4]（2）的四核簇是在反应开始时形成的动力学稳定的产物，随着时间的流逝，它转变为[Cu6（MBT）4的热力学稳定的产物。 [6]（1）具有六核簇单元。在以低浓度的起始试剂合成的样品中，与以高浓度的起始试剂合成的样品相反，
• Copper(I) and silver(I) azide complexes containing N-donor ligands
  作者：C. Pettinari

  DOI：10.1016/s0277-5387(01)00895-6

  日期：2001.9

  From the interaction of imidazole-type ligand L (L = imidazole (im), 1-methylimidazole (1-meim), 2-methylimidazole (2-meim), 4-methylimidazole (4-meim), benzimidazole (bzim), 1-benzylimidazole (bnim)) with [Cu(N-3)(PPh3)(2)](2) the new mononuclear [Cu(N-3)(PPh3)(2)(L)] and dinuclear [Cu-2(N-3)(2)(PPh3)(3)(L)] species have been obtained. Chelating bidentate ligands (L-2 = 2.2-bipyridyl (bipy), 1,10-phenanthroline (phen) or 2,9-dimethyl-1,10-phenanthroline (cupr)) react with [M(N-3)(PPh3)(2)](2) (M = Cu or Ag) yielding [M(N-3)(PPh3)(L-2)]. The S-donors 1-methyl-2-imidazol-2(3H)-thione (Hmimt), 2-benzothiazolethiol (Hbtt) and 2-pyridinethiol (Hpyt) react with [Cu(N-3)(PPh3)(2)](2) in ethanol undergoing deprotonation and yielding [Cu(mimt)(Ph3P)](n), [Cu(btt)](n) and [Cu(pyt)](n), respectively. On the contrary, Hmimt and imidazoline-2(1,3H)thione (Himt) react in diethyl ether with [Cu(N-3)(PPh3)(2)](2) yielding [Cu(N-3)(Hmimt)(3)] and [Cu(N-3)(PPh3)(Himt)], respectively. P(o-tolyl)(3) is able to displace the less basic phosphine PPh3 from [Cu(N-3)(PPh3)(cupr)] yielding the complex [Cu(N-3)P(o-tolyl)(3)}(cupr)]. 1,3-Bis(diphenylphosphino)propane (dppp) reacts with [Cu(N-3)(PPh3)(cupr)] yielding the complex [Cu-2(N-3)(2)(dppp)(3)]. [Cu(N-3)(PPh3)(2)(im)] and [Cu(N-3)(PPh3)(phen)] react with CS2 in benzene, in presence of excess of PPh3 forming [Cu(SCN)(PPh3)(2)] and [Cu(tz)(PPh3)(phen)] (Htz = 4-thia-1,2,3-triazole-5-thione), respectively. [Ag(N-3)(PPh3)(cupr)] reacts slowly with excess of CS2 in diethyl ether giving [Ag(tz)(cupr)], whereas the same reaction in benzene in excess of PPh3 yields immediately [Ag(SCN)(PPh3)(2)]. From the reaction of [Ag(N-3)(PPh3)(cupr)] with cyCN the complex [Ag(N-3)(cyCN)(PPh3)(cupr)] formed. All derivatives were characterized by IR and far-IR data, conductivity, H-1 NMR and in some cases also with P-31H-1} NMR and molecular weight measurements. (C) 2001 Elsevier Science Ltd. All rights reserved.