1-iodo-1-(morpholine-4-carbothioylsulfanyl)-tetrahydro-1λ⁴-tellurophene | 72546-41-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: 1-iodo-1-(morpholine-4-carbothioylsulfanyl)-tetrahydro-1λ⁴-tellurophene
• 英文别名: (1-iodo-1λ4-tellurolan-1-yl) morpholine-4-carbodithioate
• CAS: 72546-41-9
• 化学式: C₉H₁₆INOS₂Te
• 分子量: 472.869
• InChiKey: LNUVTEDCGOKJMU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.01
• 重原子数：
  15.0
• 可旋转键数：
  1.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  12.47
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  1-iodo-1-(morpholine-4-carbothioylsulfanyl)-tetrahydro-1λ⁴-tellurophene 、 sodium tetraphenyldithioimidodiphosphinate 以 乙醇 为溶剂， 反应 1.0h， 以50%的产率得到[1-[diphenylphosphinothioylimino(diphenyl)-λ5-phosphanyl]sulfanyl-1λ4-tellurolan-1-yl] morpholine-4-carbodithioate
  参考文献：
  名称：

  Synthesis and spectroscopic characterization of new mixed ligand organotellurium(IV) compounds employing dithiocarbamates and imidotetraphenyldithiodiphosphinates. Crystal structure of [C4H8Te(S2CNEt2){(SPPh2)2N}], [C4H8Te(S2CNC5H10){(SPPh2)2N}] and [C4H8Te(S2CNC4H8S){(SPPh2)2N}]

  摘要：

  The synthesis of new mixed ligand organotellurium(IV) compounds, [C4H8Te(S2CNEt2){(SPPh2)(2)N}] (1), [C4H8Te-(S2CNC5H10){(SPPh2)(2)N}] (2), [C4H8Te(S2CNC4H8O){(SPPh2)(2)N}] (3) and [C(4)HsTe(S2CNC4H8S){(SPPh2)(2)N}] (4), was achieved. They were characterized by FAB(+) mass spectrometry, IR, H-1-, C-13-, P-31- and Te-125-NMR spectroscopy. The crystal structures of 1, 2 and 4 were determined by X-ray diffraction. The solid state structures show that the coordination geometry can be described as the sawhorse structure typical for Te(IV) in which the lone pair is regarded as stereochemically active and occupying an equatorial position in a distorted trigonal bipyramid. Both types of ligands exhibit an anisobidentate chelating coordination mode on interaction with the tellurium center. If the aniso-bonded donor atoms are included in the coordination sphere, the coordination number increases to seven and the environment at Te can be described as the 1:2:2:2 structure. No intermolecular interaction was observed. (C) 2001 Published by Elsevier Science B.V.

  DOI：

  10.1016/s0022-328x(01)01018-x
• 作为产物：
  描述：

  1,1,2,3,4,5-hexahydro-1,1-diiodotellurophene 、 ammonium salt of N-morpholino dithiocarbamic acid 生成 1-iodo-1-(morpholine-4-carbothioylsulfanyl)-tetrahydro-1λ⁴-tellurophene
  参考文献：
  名称：

  Srivastava,T.N. et al., Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1979, vol. 18, p. 236 - 238

  摘要：

  DOI：

文献信息

• SRIVASTAVA T. N.; SRIVASTAVA R. C.; BHARGAVA A., INDIAN J. CHEM., 1979, A18, NO 3, 236-238
  作者：SRIVASTAVA T. N.、 SRIVASTAVA R. C.、 BHARGAVA A.

  DOI：——

  日期：——