2-APTZS | 1449431-85-9

• 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: 2-APTZS
• 英文别名: 2-amino pyridine bisthiourea zinc sulphate
• CAS: 1449431-85-9
• 化学式: C₇H₁₄N₆O₄S₃Zn
• 分子量: 407.814
• InChiKey: ZQUOMRWHQRSRIZ-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 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：

  2-氨基吡啶 、 硫脲 、 zinc(II) sulfate 生成 2-APTZS
  参考文献：
  名称：

  Growth and optical studies of 2-aminopyridine bis thiourea zinc sulphate (2-APTZS) single crystals for NLO applications

  摘要：

  2-Amino pyridine bisthiourea zinc sulphate (2-APTZS), a metal organic nonlinear optical singe crystal is grown by slow evaporation technique at room temperature. FTIR and NMR spectral studies confirm the chemical composition and their corresponding functional groups of the grown crystal (2-APTZS). UV-visible NIR spectral study confirms the transmission band in the range 260-900 nm with lower cutoff wavelength at 265 nm. Powder XRD study reveals the crystalline nature of the grown sample. Single crystal XRD study shows that the grown crystal is orthorhombic system of a = 6.45 angstrom, b = 9.57 angstrom, c = 13.25 angstrom, and alpha = beta = gamma = 90 degrees. Thermal and dielectric studies of as-grown crystal were studied and discussed. The SHG efficiency of the grown crystal is confirmed by the Kurtz powder technique. (c) 2013 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2013.05.052