S-methyl-β-N-(2-hydroxynaphthylmethylidene)dithiocarbazate | 136493-62-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: S-methyl-β-N-(2-hydroxynaphthylmethylidene)dithiocarbazate
• CAS: 136493-62-4
• 化学式: C₁₃H₁₂N₂OS₂
• 分子量: 276.383
• InChiKey: DUUQEQNHUHNOKW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.12
• 重原子数：
  18.0
• 可旋转键数：
  2.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  44.62
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  tetra-n-butylammonium tetrachlorooxorhenate(V) 、 S-methyl-β-N-(2-hydroxynaphthylmethylidene)dithiocarbazate 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  带有SNO / SN供体原子集的新型六配位氧杂（（V）'3 + 2'混合配体配合物

  摘要：

  配体oxorhenium（V）与二齿SN和三齿席夫碱从酮或醛与dithiocarbazic酸甲酯（H的缩合衍生的前体的交换反应2 NNHC（S）SCH 3）产生新颖“3 + 2带有SNO / SN供体原子集的混合配体络合物。因此，[NBu 4 ] [ReOCl 4 ]或Na [ReO（葡糖酸盐）2 ]与SNO配体（H 2 L n）或双齿SN（HL m）和三齿SNO（H 2 L n）的混合物反应在甲醇溶液中分别导致[ReO（L n）（HLÑ）]和[REO（L Ñ）（L米）]，结合一个三齿双阴离子小号- NO -供体的席夫碱（L）和一个二齿阴离子小号- ñ供体配体（HL）。single周围的配位几何是扭曲的八面体，每个配体的两个SN供体原子组定义了赤道面，而顶端位置被三齿SNO配体（L）的氧代基团和氧原子占据，如单晶所示。 [ReO（L 1）（HL 1）] 1的X射线衍射结构。

  DOI：

  10.1016/s0020-1693(01)00797-6
• 作为产物：
  描述：

  3-羟基萘-2-甲醛 、 肼基二硫代甲酸甲酯 以 乙醇 为溶剂， 以90%的产率得到S-methyl-β-N-(2-hydroxynaphthylmethylidene)dithiocarbazate
  参考文献：
  名称：

  氧钼-（VI）和-（IV）配合物的配体控制的合成，反应性和羰基转移动力学

  摘要：

  三官能（ONS）双阴离子席夫碱配体L 2– [H 2 L = S-甲基3-（2-羟基苯基）亚甲基-二硫代氨基甲酸酯或5-R取代基衍生物（R = H，Me，Cl，Br或NO 2）与S-苄基类似物（H 2 L'）形成鲜明对比的是，无论在取代基R上，在EtOH或MeOH中仅形成Mo O→Mo桥连的低聚物[（MoO 2 L）n ]。这些取代基R控制ν（Mo O→Mo）振动的位置，即Mo VI –Mo V对于聚合物配合物以及相关的给体分子，氧化还原对，配体到金属的电荷转移跃迁，偶氮甲碱质子信号的化学位移以及溶液中不对称的ν（Mo O）振动（D）配位单体[MoO 2 L（D）] [D =吡啶（py），二甲基甲酰胺（dmf）或Me 2 SO]。[的MoO的反应2 L]与PPH 3在CH 2氯2，MeOH或MeCN中或在供体溶剂d（DMF或吡啶）中产生oxomolybdenum（IV）的衍生物，[的MoO

  DOI：

  10.1039/dt9930001151

文献信息

• Synthesis, properties and spectroscopic studies of rhenium(v) complexes stabilized by tridentate Schiff bases derived from S-methyl dithiocarbazate
  作者：F. Mévellec、A. Roucoux、N. Noiret、H. Patin

  DOI：10.1039/b109020h

  日期：2001.12.13

  Neutral oxorhenium(V) complexes with tridentate SNO Schiff bases have been prepared by substitution reactions on the square pyramidal ionic complex [NBu4][ReVOCl4] and on the six-coordinate rhenium precursor [ReVOCl3(PPh3)2]. The chlororhenium intermediate species [ReVOCl(Ph–SNO–CH3)] 1 allows the formation of the homologous iodo complex [ReVOI(Ph–SNO–CH3)] 2 by a halogen exchange reaction with lithium iodide. The similar complexes [ReVOCl(Ph–SNO–H)] 3 and [ReVOCl(Naph–SNO–H)] 4 have been synthesised using S-methyl-β-N-(2-hydroxyphenylmethylidene)dithiocarbazate (Ph–SNO–H) and S-methyl-β-N-(2-hydroxynaphthylmethylidene)dithiocarbazate (Naph–SNO–H). The ionic complex [NBu4][ReOCl4] reacts with 4 equivalents of PPh3 and Ph–SNO–H or Naph–SNO–H to give rise to the complexes [ReVOCl(Ph–SNO–H)(PPh3)] 5 and [ReVOCl(Naph–SNO–H)(PPh3)] 7 which are smoothly converted in ethanolic solution into [ReVOCl(Ph–SNO–H)(OPPh3)] 6 and [ReVOCl(Naph–SNO–H)(OPPh3)] 8, respectively. Each compound was characterised by elemental analysis, IR, NMR spectra and FAB mass spectrometry. The crystallographic structures of [ReOI(Ph–SNO–CH3)] 2, [ReOCl(Ph–SNO–H)(PPh3)] 5 and [ReOCl(Ph–SNO–H)(OPPh3)] 6 were determined by single crystal X-ray diffraction methods.

  通过对方形金字塔离子络合物 [NBu4][ReVOCl4] 和六配位铼前体 [ReVOCl3(PPh3)2] 的取代反应，制备出了具有三叉 SNO 席夫碱的中性羰基铼（V）络合物。氯钌中间体[ReVOCl(Ph-SNO-CH3)]1 与碘化锂发生卤素交换反应，生成同源的碘络合物[ReVOI(Ph-SNO- )]2。利用 S-甲基-β-N-（2-羟基苯基亚甲基）二硫代卡巴肼（Ph-SNO-H）和 S-甲基-β-N-（2-羟基萘亚甲基）二硫代卡巴肼（Naph-SNO-H）合成了类似的络合物 [ReVOCl(Ph-SNO-H)] 3 和 [ReVOCl(Naph-SNO-H)] 4。离子络合物 [NBu4][ReOCl4] 与 4 个等量的 PPh3 和 Ph-SNO-H 或 Naph-SNO-H 反应，生成络合物 [ReVOCl(Ph-SNO-H)(PPh3)] 5 和 [ReVOCl(Naph-SNO-H)(PPh3)] 6。和[ReVOCl(Naph-SNO-H)(PPh3)]7，它们在乙醇溶液中可顺利转化为[ReVOCl(Ph-SNO-H)(OPPh3)]6 和[ReVOCl(Naph-SNO-H)(OPPh3)]8、和 [ReVOCl(Naph-SNO-H)(OPPh3)] 8。每个化合物都通过元素分析、红外光谱、核磁共振光谱和 FAB 质谱进行了表征。单晶 X 射线衍射法测定了[ReOI(Ph-SNO- )] 2、[ReOCl(Ph-SNO-H)(PPh3)] 5 和[ReOCl(Ph-SNO-H)(OPPh3)] 6 的晶体结构。
• Singh, Ritu; Mittal; Malik, Sachin, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 2007, vol. 46, # 9, p. 1406 - 1413
  作者：Singh, Ritu、Mittal、Malik, Sachin、Singh

  DOI：——

  日期：——
• The preparation and characterization of some nickel(II) and copper(II) complexes of ons ligands
  作者：M. Nazimuddin、M.Akbar Ali、F.E. Smith

  DOI：10.1016/s0277-5387(00)81265-6

  日期：1991.1

  New nickel(II) and copper(II) complexes of four Schiff base ligands formed from benzoylacetone and 2-hydroxynaphthaldehyde with S-alkyl esters of dithiocarbazic acid have been prepared and characterized by IR, NMR, ESR and electronic spectroscopic techniques. The Schiff bases yield neutral 1:1 complexes of general formula M(ONS) (ONS2- = dinegatively charged anions of the Schiff base ligands; M = Ni, Cu). Magnetic and spectral evidence support a dimeric structure for these complexes. The complexes, M(ONS)B (B = py, dipy, phen), were also prepared. The complexes, M(ONS)py, are square-planar but electronic and ESR spectroscopic data support a five-coordinate geometry for the Cu(ONS)B (B = dipy, phen) complexes. Based on spectroscopic and magnetic data, a thiolato, sulphur-bridged, octahedral structure is assigned to the Ni(ONS)B (B = dipy, phen) complexes.
• Sengupta, S. K.; Kumar, Shyam, Synthesis and Reactivity in Inorganic and Metal-Organic Chemistry, 1982, vol. 12, p. 297 - 308
  作者：Sengupta, S. K.、Kumar, Shyam

  DOI：——

  日期：——