N-2,2'-bipyridin-6-yl N-tert-butylhydroxylamine

• 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: N-2,2'-bipyridin-6-yl N-tert-butylhydroxylamine
• 英文别名: N-tert-butyl-N-(6-pyridin-2-ylpyridin-2-yl)hydroxylamine
• 化学式: C₁₄H₁₇N₃O
• 分子量: 243.308
• InChiKey: QTGFZRYPJDECNQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  49.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-2,2'-bipyridin-6-yl N-tert-butylhydroxylamine 在 silver(l) oxide 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 生成 2,2'-bipyridin-6-yl tert-butyl nitroxide
  参考文献：
  名称：

  Strongest Exchange Coupling in Gadolinium(III) and Nitroxide Coordination Compounds

  摘要：

  The largest antiferromagnetic coupling parameter was characterized to be 2J/k(B) = -15.9(2) K in [Gd(hfac)(3)(6bpyNO)], where 6bpyNO stands for 2,2'-bipyridin-6-yl tert-butyl nitroxide. This molecule was designed according to the empirical relation: more planar chelate favors stronger antiferromagnetic coupling. The Gd-Orad bond is relatively short owing to the tridentate character.

  DOI：

  10.1021/ic501496a

文献信息

• Strongest Exchange Coupling in Gadolinium(III) and Nitroxide Coordination Compounds
  作者：Takuya Kanetomo、Takayuki Ishida

  DOI：10.1021/ic501496a

  日期：2014.10.20

  The largest antiferromagnetic coupling parameter was characterized to be 2J/k(B) = -15.9(2) K in [Gd(hfac)(3)(6bpyNO)], where 6bpyNO stands for 2,2'-bipyridin-6-yl tert-butyl nitroxide. This molecule was designed according to the empirical relation: more planar chelate favors stronger antiferromagnetic coupling. The Gd-Orad bond is relatively short owing to the tridentate character.