噻菌茂 | 62303-19-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 噻菌茂
• 英文名称: 1,3-dithiolane-2-ylidenhydrazidebenzoic acid
• 英文别名: 2-Benzoylhydrazono-1,3-dithiolane；N-(1,3-dithiolan-2-ylideneamino)benzamide
• CAS: 62303-19-9
• 化学式: C₁₀H₁₀N₂OS₂
• 分子量: 238.334
• InChiKey: SMPSKHUQMNCDEB-UHFFFAOYSA-N

物化性质

• 密度：
  1.3346 (rough estimate)

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  92.1
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 储存条件：
  库房应保持通风、低温和干燥，并将库存物资与食品原料分开储存和运输。

制备方法与用途

类别：农药
毒性分级：高毒
急性毒性：

• 大鼠 LD50: 72.8 毫克/公斤
• 小鼠 LD50: 111 毫克/公斤

可燃性危险特性：燃烧时产生有毒的氮氧化物和硫氧化物气体

储运特性：库房应通风、低温且干燥；与食品原料分开存放和运输

灭火剂：干粉、泡沫或砂土

反应信息

• 作为反应物：
  描述：

  iron(III)-acetylacetonate 、 噻菌茂 以 甲醇 为溶剂， 以52%的产率得到[Fe(1,3-dithiolane-2-ylidenhydrazidebenzoic acid-1H)(acac)]
  参考文献：
  名称：

  Stability, molecular structures and magnetic properties of dinuclear iron complexes supported by benzoic hydrazide derivative ligands

  摘要：

  We report experimental evidences including molecular solid-state structure determinations, magnetic measurements and EPR studies for the formation (in the solid-state) of novel dinuclear Fe-2(III)(mu-OMe)(2)(L)(4) complexes (HL are 2-ylidenhydrazidebenzoic-1,3-dithiolane acid and N'-cyclopentylidene-2-hydroxybenzohydrazide). The two novel dinuclear iron compounds described in the present contribution exhibit antiferromagnetic intra-molecular coupling. Crystal structures of the supporting ligands as well as one mononuclear species have also been determined. (C) 2009 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.ica.2009.08.027

文献信息

• Spontaneous Reduction of High‐Spin Fe ^III Complexes Supported by Benzoic Hydrazide Derivative Ligands
  作者：Nouri Bouslimani、Nicolas Clément、Clément Toussaint、Sophie Hameury、Philippe Turek、Sylvie Choua、Samuel Dagorne、David Martel、Richard Welter

  DOI：10.1002/ejic.200900382

  日期：2009.9

  herein experimental evidence for the spontaneous reduction of new high-spin iron(III) FeIII(L(n))2Cl, L complexes to new high-spin iron(II) FeII(HL(n))2Cl2 mononuclear complexes. These processes were checked by EPR, cyclovoltammetric, and pseudo-steady voltammetric studies. Crystal structures of three new complexes (one FeIII and two FeII) were obtained from RX single-crystal diffraction.(© Wiley-VCH

  我们在此报告了新的高自旋铁 (III) FeIII(L(n))2Cl、L 配合物自发还原为新的高自旋铁 (II) FeII(HL(n))2Cl2 单核配合物的实验证据。这些过程通过 EPR、循环伏安法和伪稳态伏安法研究进行了检查。从 RX 单晶衍射中获得了三个新配合物（一个 FeIII 和两个 FeII）的晶体结构。 (© Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2009)
• Stability, molecular structures and magnetic properties of dinuclear iron complexes supported by benzoic hydrazide derivative ligands
  作者：Nouri Bouslimani、Nicolas Clément、Guillaume Rogez、Philippe Turek、Sylvie Choua、Samuel Dagorne、Richard Welter

  DOI：10.1016/j.ica.2009.08.027

  日期：2010.1

  We report experimental evidences including molecular solid-state structure determinations, magnetic measurements and EPR studies for the formation (in the solid-state) of novel dinuclear Fe-2(III)(mu-OMe)(2)(L)(4) complexes (HL are 2-ylidenhydrazidebenzoic-1,3-dithiolane acid and N'-cyclopentylidene-2-hydroxybenzohydrazide). The two novel dinuclear iron compounds described in the present contribution exhibit antiferromagnetic intra-molecular coupling. Crystal structures of the supporting ligands as well as one mononuclear species have also been determined. (C) 2009 Elsevier B. V. All rights reserved.