piperazine-1,4-diium heptafluorotantalate(V) | 1251826-43-3

• 英文名称: piperazine-1,4-diium heptafluorotantalate(V)
• CAS: 1251826-43-3
• 化学式: C₄H₁₂N₂*F₇Ta
• 分子量: 402.089
• InChiKey: YVQHODORPQXJEN-UHFFFAOYSA-I

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：

  哌嗪 、 tantalum(V) oxide 、 氢氟酸 以 氢氟酸 、 水 、 乙二醇 为溶剂， 生成 piperazine-1,4-diium heptafluorotantalate(V)
  参考文献：
  名称：

  Hydrothermal syntheses, crystal structures and characterizations of two new metal-fluorides based on niobium and tantalum

  摘要：

  Two novel metal-fluorides [H2N(C2H4)(2)NH2][NbOF5](1) and [H2N(C2H4)(2)NH2][TaF2](2) have been obtained by a two-step hydrothermal method and characterized by elemental analysis, IR. PXRD, EDS. TG analysis and single-crystal X-ray diffraction. X-ray diffraction reveals that both compounds exhibit the supramolecular architectures through the electrostatic interactions and hydrogen bonding interactions between protonated piperazine and anions. In the [NbOF5](2-) of compound 1, the Nb atom moves from the center of the octahedron toward the oxide atom to form a short Nb=0 bond and long terminal Nb-F bond. In compound 2, the Ta atom can be described as a pentagonal bipyramidal geometry coordinated by seven fluorine atoms. Furthermore, the UV spectra in solid state of compounds 1 and 2 have also been discussed, which shows both of them have strong absorption bands. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.inoche.2010.06.019