copper(II) diethyldithiocarbamate | 15664-03-6

• 分子结构分类: 有机化合物 - 有机盐 - 有机金属盐
• 英文名称: copper(II) diethyldithiocarbamate
• 英文别名: dicopper;N,N-diethylcarbamodithioate
• CAS: 15664-03-6；23626-13-3；33939-19-4
• 化学式: C₂₀H₄₀Cu₂N₄S₈
• 分子量: 720.184
• InChiKey: QHQYJMNSCQGLJD-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  4.64
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  145
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  copper(II) diethyldithiocarbamate 、 足球烯 以 氯苯 为溶剂， 生成 (copper(II) diethyldithiocarbamate)2*C60
  参考文献：
  名称：

  富勒烯与二价金属二硫代氨基甲酸盐的配合物：结构、磁性和光电导

  摘要：

  富勒烯 C60 和 C70 与金属二硫代氨基甲酸酯 {MII(R2dtc)2}·Cm (m = 60 或 70) 和金属二硫代氨基甲酸酯与含氮配体 (L) 配位的一系列配合物，{MII(R2dtc)2)x· L}·C60 (x = 1 或 2)，其中 M = Cu、Zn、Cd、Hg、Mn 或 Fe，R = Me、Et、Prn、Pri 或 Bun，L 为 1,4-二氮杂双环[2.2 .2] 辛烷 (DABCO)、N,N'-二甲基哌嗪或六亚甲基四胺被合成。二硫代氨基甲酸酯分子的形状与 C60 的球形形状在空间上相容，导致它们的 π 系统之间有效相互作用。所得化合物的特征在于富勒烯分子的分层或三维堆积。在 C60 复合物中，二硫代氨基甲酸铁 (II) 和二硫代氨基甲酸锰 (II) 以高自旋状态 (S = 2 和 5/2) 存在。{MII(Et2dtc)2}2·Cm (M = Fe or Mn, m

  DOI：

  10.1007/s11172-007-0339-y
• 作为产物：
  描述：

  sodium N,N-diethyldithiocarbamate 、 copper(II) perchlorate 以 乙醇 为溶剂， 生成 copper(II) diethyldithiocarbamate
  参考文献：
  名称：

  The crystal structure, equilibrium and spectroscopic studies of bis(dialkyldithiocarbamate) copper(II) complexes [Cu2(R2dtc)4] (dtc=dithiocarbamate)

  摘要：

  Four copper(II) complexes of bis(dialkyldithiocarbamate) [Cd(R(2)dtc)(2)] (R=Me, Et, Pr, i-Pr; dtc=dithiocarbamate) have been prepared and characterized by elemental analysis, IR and ESR spectra studies. Their equilibrium constants (K), determined by a W-vis spectrometry in EtOH, were influenced by the alkyl, groups in the following order: i-Pr>n-Pr approximate to Et>Me. The single crystal structures of complex [Cu-2(R(2)dtc)(4)] have been determined using X-ray diffraction methods. The compounds [Cu-2(Et(2)dtc)(4)] and [Cu-2(Pr(2)dtc)(4)] are built of centrosymmetric neutral dimeric [Cu-2(R(2)dtc)(4)] entities. The copper atom lies in a distorted square-pyramidal environment. The four equatorial donors are two bidentate chelate sulfur atoms from two dtc ligands. One of-the sulfur atoms from the third dtc ligand acts as a bridging ligand occupying the apical position of the symmetry-related copper atom in the dimer structure, which is viewed as two edge-sharing distorted square-pyramids. The structure of [Cu-2(i-Pr(2)dtc)(4)] is square planar with an exactly planar CuS4 unit and nearly planar NCS2 moieties. The Cu-S distances shows small decreases along the series n-Pr>Et>i-Pr, the biggest change being for the diisopropyl complex. The alkyl substituents at the nitrogen atom affect their coordination number and Cu Cu distance. In the solid, [Cu-2(n-Pr(2)dtc)(4)] has the shortest Cu ... Cu distance and [Cu(i-Pr(2)dtc)(2)] has the longest one. (C) 1999 Elsevier Science Ltd. Ail rights reserved.

  DOI：

  10.1016/s0277-5387(99)00242-9

文献信息

• Synthesis, structures and properties of three copper complexes with dibutyldithiocarbamate ligand
  作者：Chen Wang、Jiao Niu、Jun Li、Xiaoxun Ma

  DOI：10.1016/j.molstruc.2017.01.021

  日期：2017.5

  sulfur-containing dibutyldithiocarbamate ligand (DDTC), [(Et 2 NCS 2 ) 4 Cu 2 ] ( 1 ), [(Et 2 NCS 2 )(EtO)Cu] 2 ( 2 ) and [(Et 2 NCS 2 ) 6 Cu 13 I 10 ] n ( 3 ) have been synthesized through the reaction of CuI with different mole ratios of DDTC under solution-diffusion conditions. The single crystal X-ray diffraction revealed that divalent Cu cations in complexes 1 and 2 imply that the reactant, Cu(I), was

  摘要 含硫二丁基二硫代氨基甲酸酯配体(DDTC)、[(Et 2 NCS 2 ) 4 Cu 2 ] ( 1 )、[(Et 2 NCS 2 )(EtO)Cu] 2 ( 2 ) 和[(Et 2 NCS 2 ) 6 Cu 13 I 10 ] n ( 3 )是通过CuI与不同摩尔比的DDTC在溶液扩散条件下反应合成的。单晶 X 射线衍射显示配合物 1 和 2 中的二价 Cu 阳离子意味着反应物 Cu(I) 参与了氧化还原过程。他们分别根据 DDTC 配体的桥连 S 和乙醇分子的 O 原子形成双核复合物。混合价Cu阳离子在配合物3中具有两种配位环境，并通过桥接五核Cu（I）簇和Cu（II）形成二维层状配位聚合物。粉末X射线衍射，发光，
• A Facile Synthesis, Crystallographic, Spectral, Thermal, and Electrochemical Investigations of Neutral [Cu₂(Et₂dtc)₄] Dimer
  作者：Sanjay K. Verma、Rahul Kadu、Vinay K. Singh

  DOI：10.1080/15533174.2013.776596

  日期：2014.3.16

  A neutral dimeric complex [Cu-2(Et(2)dtc)(4)] (dtc = dithiocarbamate) (1) was synthesized in single step under mild conditions. Structure of 1 has been studied using single-crystal XRD to gauge the influence of CH3 and CH2 groups of coordinated dithiocarbamate ligands on the association of the molecules in solid state. Evidently 1 features the ability of these groups to form intermolecular (sp(3))CH(chelate ring) and (sp(3))CHS stacking interactions leading to fascinating 3D infinite network. Complex has been completely characterized by spectrophotometric methods, optical behavior, and thermal and cyclic voltammetry studies. Cyclic voltammetric study confirmed the binding affinity of 1 toward H2PO- (4). Supplemental materials are available for this article. Go to the publisher's online edition of Synthesis and Reactivity in Inorganic, Metal-Organic, and Nano-Metal Chemistry to view the supplemental file.