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Synthesis and spectral studies of 2-aminopyridinium para-nitrobenzoate: A novel optoelectronic crystal

机译:对氨基苯甲酸2-氨基吡啶鎓的合成与光谱研究:新型光电子晶体

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摘要

A new crystal 2-aminopyridinium para-nitro benzoate (C_5H_7N_2~+·C_7H_4NO_4~-) has been synthesized by the reaction of 2-aminopyridine with para-nitro benzoic acid by slow evaporation method. As synthesized crystals have been characterized by X-ray diffraction (XRD), Fourier transformed infrared (FTIR), and Ultra violet (UV) spectral studies. The XRD and FTIR results indicated that the synthesized compound has the crystal structure of monoclinic with space group P2_1 with lattice parameters a, b, c and β of 7.9403(12) A, 6.7719(6) A, 11.1120(15) A and 99.272(6)° respectively. The synthesized crystal exhibits the UV absorption edge at around 334 nm with the estimated direct band gap (E_g) of 3.53 eV. It is observed from the above studies that the crystal has the maximum transparency in the entire visible region and hence the crystal should exhibit a nonlinear optical property. Further the band gap of the as synthesized crystals was determined to be around 3.53 eV, which makes the crystal suitable for the fabrication of optoelectronic devices. The crystal does not have any inversion symmetry and hence it also exhibits piezoelectricity.
机译:通过慢速蒸发法使2-氨基吡啶与对硝基苯甲酸反应,合成了新的对氨基苯甲酸2-氨基吡啶鎓晶体(C_5H_7N_2〜+·C_7H_4NO_4〜-)。通过X射线衍射(XRD),傅立叶变换红外(FTIR)和紫外(UV)光谱研究对合成晶体进行了表征。 XRD和FTIR结果表明,所合成的化合物具有单斜晶体的晶体结构,其空间群为P2_1,晶格参数a,b,c和β为7.9403(12)A,6.7719(6)A,11.1120(15)A和99.272。 (6)°。合成的晶体在约334 nm处显示UV吸收边缘,估计的直接带隙(E_g)为3.53 eV。从以上研究中观察到,该晶体在整个可见光区域具有最大的透明度,因此该晶体应表现出非线性光学性质。此外,所确定的合成晶体的带隙被确定为约3.53eV,这使得该晶体适合于制造光电器件。晶体不具有任何反转对称性,因此还具有压电性。

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