tris(2-pyridinethiolato)(p-tolyl)tin(IV) | 154069-90-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: tris(2-pyridinethiolato)(p-tolyl)tin(IV)
• 英文别名: methylbenzene;pyridine-2-thiolate;tin(4+)
• CAS: 154069-90-6
• 化学式: C₂₂H₁₉N₃S₃Sn
• 分子量: 540.321
• InChiKey: AVIZSFZZHHNHEJ-UHFFFAOYSA-K

计算性质

• 辛醇/水分配系数(LogP)：
  4.38
• 重原子数：
  29
• 可旋转键数：
  0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  41.7
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-巯基吡啶 、 trichloro-4-tolylstannane 在 NaOMe 作用下， 以 甲醇 为溶剂， 生成 tris(2-pyridinethiolato)(p-tolyl)tin(IV)
  参考文献：
  名称：

  Tris(2-pyridinethiolato)(p-tolyl)tin(IV), [Sn(C5H4NS)3(C7H7)]

  摘要：

  In the title compound three bidentate 2-pyridinethiolato ligands (2-SPy) together with p-tolyl form a distorted pentagonal bipyramid around Sn. Two S atoms and three N atoms form the pentagonal plane. One S and the C(p-tolyl) atom are in the axial positions. The distortion of the molecule is explicated by the axial S-Sn-C angle of 156.0 (3)-degrees and by the distance of 0.635 (7) angstrom of one of the N atoms from the pentagonal plane. The Sn-S distances in the plane are longer [2.571 (3) angstrom] than the axial Sn-S bond [2.486 (3) angstrom]. The Sn-N distances are in the range 2.468 (8) +/- 0.024 angstrom. Intermolecular distances shorter than the sum of the van der Waals radii do not exist.

  DOI：

  10.1107/s0108270193007310