[Nd(2,6-di-tert-butyl-4-methyl-phenolate)4][Na(THF)6] | 328240-77-3

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: [Nd(2,6-di-tert-butyl-4-methyl-phenolate)4][Na(THF)6]
• CAS: 328240-77-3
• 化学式: C₂₄H₄₈NaO₆*C₆₀H₉₂NdO₄
• 分子量: 1477.26
• InChiKey: TWCREVHTGCGZMD-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
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• 重原子数：
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• 可旋转键数：
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• 环数：
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• sp3杂化的碳原子比例：
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• 拓扑面积：
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• 氢给体数：
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• 氢受体数：
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反应信息

• 作为产物：
  描述：

  四氢呋喃 、 sodium 2,6-di-tert-butyl-4-methylphenoxide 、 三氯化钕 以 四氢呋喃 为溶剂， 以51%的产率得到[Nd(2,6-di-tert-butyl-4-methyl-phenolate)4][Na(THF)6]
  参考文献：
  名称：

  Syntheses and crystal structures of four-coordinate aryloxo neodymium complexes

  摘要：

  Two four-coordinate complexes of neodymium with 2,6-di-tert-butyl-4-methylphenolate have been synthesized and their single-crystal structures determined. Anhydrous NdCl3 reacted with ArONa in a 1:3 molar ratio in THF at room temperature to yield the neutral four-coordinate complex [(ArO)(3)Nd(THF)]. MePh (1), which crystallized as a solvate. in which three aryloxide ligands and one THF ligand are coordinated to neodymium to form a slightly distorted tetrahedron. The reaction of NdCl3, with 4 equiv. of ArONa in THF gave [(ArO)(4)Nd][Na(THF)(6)] (2). In this anion-cation pair compound, the neodymium and sodium atoms exhibit distorted tetrahedral and distorted octahedral coordination geometry, respectively. The average Nd-O(Ar) distance is 2.176 and 2.230 Angstrom in complex 1 and 2, respectively. (C) 2000 Elsevier Science B.V. All rights reserved.

  DOI：

  10.1016/s0277-5387(00)00535-0