[phenyltris((tert-butylthio)methyl)borate]Fe(CO)2 | 1013928-05-6

• 英文名称: [phenyltris((tert-butylthio)methyl)borate]Fe(CO)2
• CAS: 1013928-05-6
• 化学式: C₂₃H₃₈BFeO₂S₃
• 分子量: 509.41
• InChiKey: HUBLDJSGJMAJDR-UHFFFAOYSA-N

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：

  [phenyltris((tert-butylthio)methyl)borate]Fe(PMe3) 、 一氧化碳 以 正戊烷 为溶剂， 生成 [phenyltris((tert-butylthio)methyl)borate]Fe(CO)2
  参考文献：
  名称：

  Monovalent Iron in a Sulfur-Rich Environment

  摘要：

  A series of low-coordinate, paramagnetic iron complexes in a tris(thioether) ligand environment have been prepared. Reduction of ferrous {[PhTt(tBu)]FeCl}(2) [1; PhTt(tBu) = phenyltris((tert-butylthio)methyl)borate] with KC8 in the presence of PR3 (R = Me or Et) yields the high-spin, monovalent iron phosphine complexes [PhTt(tBu)]Fe(PR3) (2). These complexes provide entry into other low-valent derivatives via ligand substitution. Carbonylation led to smooth formation of the low-spin dicarbonyl [PhTttBu]Fe(CO)2 (3). Alternatively, replacement of PR3 with diphenylacetylene produced the high-spin alkyne complex [PhTt(tBu)]Fe(PhCCPh) (4). Lastly, 2 equiv of adamantyl azide undergoes a 3 + 2 cycloaddition at 2, yielding high-spin dialkyltetraazadiene complex 5.

  DOI：

  10.1021/ic7023378