chlorobis(N,N-dimethyldithiocarbamato)iron(III) | 14879-21-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: chlorobis(N,N-dimethyldithiocarbamato)iron(III)
• 英文别名: iron(III)-chlorobisdithiodimethyl-carbamate；N,N-dimethylcarbamodithioate;iron(3+);chloride
• CAS: 14879-21-1
• 化学式: C₆H₁₂ClFeN₂S₄
• 分子量: 331.739
• InChiKey: WGYUHJGNVXACHK-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  -2.24
• 重原子数：
  14
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  72.7
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  chlorobis(N,N-dimethyldithiocarbamato)iron(III) 在 溴 作用下， 以 not given 为溶剂， 生成
  参考文献：
  名称：

  卤代双（N，N-二烷基二硫代氨基甲酸酯）铁（III）配合物作为潜在的烯烃加成反应的催化剂

  摘要：

  在催化量的卤代双二硫代氨基甲酸酯化铁（III）的存在下，将分子卤素迅速地添加到烯烃中以提供顺式加成产物。

  DOI：

  10.1039/c39850001404
• 作为产物：
  描述：

  tris(N,N-dimethyldithiocarbamato)iron(IV) tetrachloroferrate(III) 以 乙醇 为溶剂， 生成 chlorobis(N,N-dimethyldithiocarbamato)iron(III)
  参考文献：
  名称：

  Oxidation of tetramethylthiuram sulfide and iron(III) dithiocarbamates with ferric chloride

  摘要：

  The title systems lead to the haloferrate(III) salt of the large 3,5-bis(N,N-dimethyliminium)-1,2,4-trithiolane cation. Oxidation of the iron(III) dithiocarbamates occurs stepwise through the formation of several intermediates, which are isolated and characterized. An alternative route to the oxidation of the thiuram sulfide is presented. All compounds were characterized by analyses, IR and UV spectroscopy, as well as magnetic measurements.

  DOI：

  10.1016/0277-5387(95)00380-0

文献信息

• Heat capacity of a five-coordinated iron(III) complex, chlorobis(N, N-dimethyldithiocarbamato) iron(III), between 0.4 and 300 k: New finding of a magnetic phase transition
  作者：Masanori Yoshikawa、Michio Sorai、Hiroshi Suga

  DOI：10.1016/0022-3697(84)90072-6

  日期：1984.1

  Abstract The heat capacity of bromobis( N , N -dimethyldithiocarbamato)iron(III) was measured between 0.4 and 300 K. A phase transition from a ferromagnetic to a paramagnetic state was found at T c = (0.837 ± 0.005) K, and a Schottky anomaly arising from the zero-field splitting was observed around 9 K. The total magnetic entropy and enthalpy, including the phase transition and the Schottky anomaly

  摘要 在 0.4 和 300 K 之间测量了溴双 (N , N - 二甲基二硫代氨基甲酸) 铁 (III) 的热容量。在 T c = (0.837 ± 0.005) K 处发现了从铁磁态到顺磁态的相变，并且 a在 9 K 附近观察到由零场分裂引起的肖特基异常。 总磁熵和磁焓，包括相变和肖特基异常，为 (11.74 ± 0.01) JK -1 mol -1 和 (92.0 ± 0.4) J mol -1 ，分别。熵仅比 R ln 4 (= 11.53 JK -1 mol -1 ) 大 1.8%，证实自旋流形确实是四重奏（中间自旋 S = 3 2 ）。跃迁熵和焓分别估计为（6.05±0.01）JK -1 mol -1 和（5.77±0.01）J mol -1 。跃迁熵仅比 R ln 2 大 5%。由于本化合物的基自旋态的特征是 S = 3 2 态零场分裂成两个克莱默双峰，相变只与基克拉默双峰有关。与乙基同系物相比，T
• Investigation of the reactions of iron(III) halobisdithiocarbamates with halogens: a novel series of fluxional homobinuclear iron(III) complexes with two different coordination spheres around the magnetic centers
  作者：F.D. Vakoulis、G.A. Katsoulos、C.A. Tsipis

  DOI：10.1016/s0020-1693(00)84487-4

  日期：1986.2
• Katsoulos, George A.; Tsipis, Constantinos A.; Vakoulis, Fotios D., Canadian Journal of Chemistry, 1985, vol. 63, p. 3249 - 3255
  作者：Katsoulos, George A.、Tsipis, Constantinos A.、Vakoulis, Fotios D.

  DOI：——

  日期：——
• Halogenobis(N,N-dialkyldithiocarbamato)iron(III) complexes as potential catalysts for halogen addition reactions to alkenes
  作者：Constantinos A. Tsipis、George A. Katsoulos、Fotios D. Vakoulis

  DOI：10.1039/c39850001404

  日期：——

  In the presence of a catalytic amount of iron(III) halogenobisdithiocarbamates, the addition of molecular halogens to alkenes occurs rapidly to afford cis-addition products.

  在催化量的卤代双二硫代氨基甲酸酯化铁（III）的存在下，将分子卤素迅速地添加到烯烃中以提供顺式加成产物。
• Oxidation of tetramethylthiuram sulfide and iron(III) dithiocarbamates with ferric chloride
  作者：L.I. Victoriano、J.A. Gnecco、H.V. Carbacho

  DOI：10.1016/0277-5387(95)00380-0

  日期：1996.4

  The title systems lead to the haloferrate(III) salt of the large 3,5-bis(N,N-dimethyliminium)-1,2,4-trithiolane cation. Oxidation of the iron(III) dithiocarbamates occurs stepwise through the formation of several intermediates, which are isolated and characterized. An alternative route to the oxidation of the thiuram sulfide is presented. All compounds were characterized by analyses, IR and UV spectroscopy, as well as magnetic measurements.