2-aminoethan-1-aminium vanadium(V) fluoride dihydride phosphate | 235107-27-4

• 英文名称: 2-aminoethan-1-aminium vanadium(V) fluoride dihydride phosphate
• CAS: 235107-27-4
• 化学式: C₂H₉N₂*F*O₄P*V
• 分子量: 226.018
• InChiKey: ZBOPVIHRIMROAL-UHFFFAOYSA-K

物化性质

• 熔点：
  >290 °C (decomp)

计算性质

• 辛醇/水分配系数(LogP)：
  -7.64
• 重原子数：
  11.0
• 可旋转键数：
  1.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  139.91
• 氢给体数：
  2.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  vanadia 、 磷酸 、 氢氟酸 、 乙二胺 以 水 为溶剂， 生成 2-aminoethan-1-aminium vanadium(V) fluoride dihydride phosphate
  参考文献：
  名称：

  Hydrothermal synthesis, structural characterization and thermal, spectroscopic and magnetic properties of the inorganic–organic hybrid phosphate, [(C2N2H9)VF(PO4)]

  摘要：

  The [(C2N2H9)VF(PO4)] compound has been synthesized by hydrothermal techniques under autogeneous pressure at 170degreesC. The compound was characterized from X-ray powder diffraction data with the Rietveld method. Its crystal structure consists of sheets linked by the ethylenediammonium cations and constructed by chains of VO3F2N octahedra. The thermal study indicates that the compound is stable up to 290degreesC. In the IR spectrum the bands of both the ethylenediammonium and phosphate ions are observed. From the reflectance diffuse spectrum the Dq and Racah parameters have been calculated. The magnetic measurements indicate the presence of antiferromagnetic interactions. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0025-5408(02)00938-8