nickel(II) diethyldithiocarbamate | 52610-81-8

• 分子结构分类: 有机化合物 - 有机硫化合物
• 英文名称: nickel(II) diethyldithiocarbamate
• 英文别名: [Ni(dedtc)₂]；[Ni(diethyldithiocarbamate)₂]；N,N-diethylcarbamodithioate;nickel(2+)
• CAS: 52610-81-8
• 化学式: C₁₀H₂₀N₂NiS₄
• 分子量: 355.236
• InChiKey: NCLUCMXMAPDFGT-UHFFFAOYSA-L

物化性质

• 保留指数：
  3007

计算性质

• 辛醇/水分配系数(LogP)：
  2.32
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  72.7
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  nickel(II) diethyldithiocarbamate 以 solid matrix 为溶剂， 生成 bis(diethyldithiocarbamate)nickel(III)
  参考文献：
  名称：

  Evidence for metal to solvent charge transfer photooxidation of iron, cobalt, nickel and copper dithiocarbamato derivatives in poly(vinylchloride) matrices at ca. 90K: New insights into the bonding of late transition metals with dithiocarbamate ligands through DFT modeling

  摘要：

  Photolysis of FeL3, CoL3, NiL2, CuL2 and ZnL2, where L = S2CNEt2, in PVC matrices at ca. 90 K results in photooxidation of the metal complexes through irreversible metal to solvent charge transfer. DFT quantum mechanical studies of the S2CNMe2 anion and the Ni, Cu and Zn derivatives were carried out, providing a more nuanced understanding of the bonding of the dithiocarbamate ligand than suggested by classical resonance arguments. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.ica.2007.08.017
• 作为产物：
  描述：

  tris(N,N-diethyldithiocarbamato)nickel(IV) tetrafluoroborate 以 乙腈 为溶剂， 生成 nickel(II) diethyldithiocarbamate
  参考文献：
  名称：

  Eckstein, P.; Hoyer, E., Zeitschrift fur Anorganische und Allgemeine Chemie

  摘要：

  DOI：

文献信息

• Cytotoxicity, anti‐microbial studies of M( <scp>II</scp> )‐dithiocarbamate complexes, and molecular docking study against <scp>SARS COV2 RNA</scp> ‐dependent <scp>RNA</scp> polymerase
  作者：Ahmed S. M. Al‐Janabi、Abdulrahman M. Saleh、Mohammad R. Hatshan

  DOI：10.1002/jccs.202000504

  日期：——

  typhimurium bacteria. The cytotoxicity of the Pd(II) and Pt(II) complexes was screened against the MCF-7 breast cancer cell line and the complexes showed moderate activity compared with the cis-platin. The results indicated that the MCF7 cells treated with 500 μg\ml of ligands and Pd(II) and Pt(II) complexes after 24 hr exposure showed intercellular space and dead cells. Finally, molecular docking studies were

  十种类型为 [M( κ 2 -Et 2 DT) 2 ] ( 1–5 ) 和 [M( κ 2 -PyDT) 2 ] ( 6–10 ) 的过渡金属二硫代氨基甲酸盐 (DTC) 配合物（其中 M = Co 、Ni、Cu、Pd 和 Pt；Et 2 DT = 二乙基二硫代氨基甲酸酯；PyDT = 吡咯烷二硫代氨基甲酸酯）通过不同的方法进行合成和表征。二硫代氨基甲酸盐充当双齿螯合配体，与Co(II)离子形成四面体络合物，并与其他过渡金属离子形成方形平面络合物。二硫代氨基甲酸盐复合物对病原体细菌表现出良好的活性。结果表明，Pt-二硫代氨基甲酸盐复合物对所有测试细菌的活性均高于 Pd-二硫代氨基甲酸盐复合物。二硫代氨基甲酸盐复合物对大肠杆菌表现出最大的抑制区，而二硫代氨基甲酸盐对鼠伤寒沙门氏菌的活性最低。Pd(II) 和 Pt(II) 复合物针对 MCF-7 乳腺癌细胞系的细胞毒性进行了筛选，与顺铂相比，
• Induction of Necroptosis in Cancer Stem Cells using a Nickel(II)‐Dithiocarbamate Phenanthroline Complex
  作者：Marie Flamme、Paul B. Cressey、Chunxin Lu、Peter M. Bruno、Arvin Eskandari、Michael T. Hemann、Graeme Hogarth、Kogularamanan Suntharalingam

  DOI：10.1002/chem.201701837

  日期：2017.7.18

  nickel(II)-dithiocarbamate phenanthroline complexes is reported. The complexes 1–6 kill bulk cancer cells and cancer stem cells (CSCs) with micromolar potency. Two of the complexes, 2 and 6, kill twice as many breast cancer stem cell (CSC)-enriched HMLER-shEcad cells as compared to breast CSC-depleted HMLER cells. Complex 2 inhibits mammosphere formation to a similar extent as salinomycin (a CSC-specific toxin)

  报道了一系列镍（II）-二硫代氨基甲酸酯菲咯啉配合物的细胞毒性。配合物1至6具有微摩尔效价，可杀死大量癌细胞和癌症干细胞（CSC）。配合物2和6中的两种，杀死富含乳腺癌干细胞（CSC）的HMLER-shEcad细胞的数量是耗尽乳腺癌CSC的HMLER细胞的两倍。复合物2抑制乳腺球形成的程度与盐霉素（一种CSC特异性毒素）相似。详细的机械研究表明2通过坏死性程序化形式的坏死病诱导CSC死亡。具体来说，2触发MLKL磷酸化，低聚和易位至细胞膜。另外，2诱导坏死体介导的碘化丙啶（PI）摄取和线粒体膜去极化，以及与坏死病一致的形态变化。令人惊讶的是，2不会通过细胞内活性氧（ROS）的产生或聚（ADP）核糖聚合酶（PARP-1）的活化而引起坏死。
• The synthesis and characterisation of [Pd(S2CNEt2)(Ph2PCH2CH2PPh2]+ salts of some chloro- and bromo-metallate anions—X-ray crystal structures of [Pd(S2CNEt2)(Ph2PCH2CH2PPh2)+[MCl2]− (M = Cu, Ag)
  作者：George Exarchos、Stanley C Nyburg、Stephen D Robinson

  DOI：10.1016/s0277-5387(97)00386-0

  日期：1998.1

  dithiocarbamates) [M(S2CNR2)2] (M = Pb, Zn, Cd, Hg, Cu, Ni, MoO2, VO; R = Et, Bun), in refluxing dicloromethane, to afford the known complexes [|PdCl(S2CNR2)|2] in virtually quantitative yield. In boiling acetonitrile the diphosphine complexes [PdX2(Ph2PCH2CH2PPh2)] (X = Cl, Br) react readily with bi- and trivalent metal diethyl dithiocarbamates [M(S2CNEt2)n] (M = Pb, Zn, Cd, Hg. Ni, MoO2, VO n = 2; M = Co, Fe

  钯配合物[PdCl 2（PhCN）2 ]容易与金属双（二烷基二硫代氨基甲酸酯）[M（S 2 CNR 2）2 ]反应（M = Pb，Zn，Cd，Hg，Cu，Ni，MoO 2，VO； R = Et，Bu n），在回流的二氯甲烷中，得到已知的络合物[| PdCl（S 2 CNR 2）|。2 ]几乎定量的产率。在沸腾的乙腈中，二膦配合物[PdX 2（Ph 2 PCH 2 CH 2 PPh 2）]（X = Cl，Br）容易与二价和三价金属二乙基二硫代氨基甲酸酯[M（S 2CNEt 2）n ]（M = Pb，Zn，Cd，Hg。Ni ，MoO 2，VO n = 2; M = Co，Fe，Mn，n = 3）得到通式[Pd（S 2 CNEt 2）（Ph 2 PCH 2 CH 2 PPh 2）] 2 + [MX 4 ] 2-。铜（II）和银（I）的二乙基二硫代氨基甲酸酯形成[Pd（S 2 CNEt 2）（Ph
• The synthesis of new bimetallic complex salts by halide/sulfur chelate cross transfer: X-ray crystal structures of the salts [Ni(S2CNEt2)(dppe)]2[HgBr4], [Pt(S2CNEt2)(dppe)]2[CdCl4], [Co(S2CNEt2)2(dppe)]2[Cl3ZnO:(Ph)2PCH2CH2P(Ph)2:OZnCl3] and [Pd(S2CNnBu2)(bipy)]2[CdCl4]
  作者：George Exarchos、Stephen D Robinson、Jonathan W Steed

  DOI：10.1016/s0277-5387(01)00885-3

  日期：2001.11

  [Zn(S2CNEt2)2] in the presence of (S2CNEt2)2 affords the novel complex [Co(S2CNEt2)2(dppe)]2[Cl3ZnO:(Ph)2PCH2CH2P(Ph)2:OZnCl3]. A selection of these salts have been fully characterised by elemental analysis and spectroscopic techniques, the remainder have been identified by spectroscopic methods alone. X-ray crystal structures are reported for the salts [Ni(S2CNEt2)(dppe)]2 [HgBr4], [Pt(S2CNEt2)(dppe)]2[CdCl4]

  摘要镍和铂配合物[MX2（dppe）]（X = Cl，Br）与二价和三价金属二乙基二硫代氨基甲酸酯[M'（S2CNEt2）n]（M'= Pb，Zn，Cd，Hg，Ni ，MoO 2，VO，n ＝ 2； M′＝ Co，Fe，Mn，n ＝ 3）得到盐[M（S 2 CNEt 2）（dppe）] 2 [M′X 4]；涉及[Cu（S2CNEt2）2]和[Ag（S2CNEt2）]的反应生成的盐形式为[M（S2CNEt2）（dppe）] [M'X2]（M'= Cu，Ag）。顺式[RuCl2（dppm）2]，[CoCl2（dppe）]和[PdX2（bipy）]络合物同样与相同的二硫代氨基甲酸酯反应形成盐[Ru（S2CNEt2）（dppe）2] 2 [M'Cl4] [ Co（S2CNEt2）2（dppe）] 2 [M'Cl4]和[Pd（S2CNnBu2）（bipy）] 2 [M'X4]。涉及其他S-螯合物的配
• Synthesis, Crystal Structures, Magnetic Properties and Photoconductivity of C ₆₀ and C ₇₀ Complexes with Metal Dialkyldithiocarbamates M(R ₂ dtc) <i> _x </i> , where M = Cu ^II , Cu ^I , Ag ^I , Zn ^II , Cd ^II , Hg ^II , Mn ^II , Ni ^II , and Pt ^II ; R = Me, Et, and <i>n</i> Pr
  作者：Dmitri V. Konarev、Andrey Y. Kovalevsky、Salavat S. Khasanov、Gunzi Saito、Dmitri V. Lopatin、Alexey V. Umrikhin、Akihiro Otsuka、Rimma N. Lyubovskaya

  DOI：10.1002/ejic.200501110

  日期：2006.5

  New complexes of fullerenes C 60 and C 70 with metal dialkyldithiocarbamates, [M(R 2 dtc) x ]·[C 60 ( 70 )]·[Solvent], R = Et [M = Cu II (C 60 , 1; C 70 , 2), Cu I (C 60 , 3; C 70 , 4), Ag I (C 60 , 5), Zn II (C 60 , 6), Cd II (C 60 , 7; C 70 , 8), Hg II (C 60 , 9), Mn II (C 70 , 10)], R = Et and Me [M = Cu II (C 60 , 11), and Zn II (C 60 , 12)], and R = nPr [M = Cu II (C 60 , 13), Ni II (C 60 , 14)

  富勒烯 C 60 和 C 70 与金属二烷基二硫代氨基甲酸盐的新配合物，[M(R 2 dtc) x ]·[C 60 ( 70 )]·[溶剂]，R = Et [M = Cu II (C 60 , 1; C 70, 2), Cu I (C 60, 3; C 70, 4), Ag I (C 60, 5), Zn II (C 60, 6), Cd II (C 60, 7; C 70, 8) , Hg II (C 60 , 9), Mn II (C 70, 10)], R = Et and Me [M = Cu II (C 60, 11), and Zn II (C 60, 12)], and R得到=nPr[M=Cu II (C 60, 13), Ni II (C 60, 14), 和Pt II (C 60, 15)]。M(R 2 dtc) x 与作为四面体单体 (6, 12)、二聚体 (1, 7

表征谱图