Growth, structure, spectral and optical properties of semiorganic crystal: Pyridine-1-ium-2-carboxylatehydrogenbromide

被引：10

作者：

Gowri, S. ^{[1
]}

Devi, T. Uma ^{[2
]}

Priya, S. ^{[1
]}

Dilip, C. Surendra ^{[3
]}

Selvanayagam, S. ^{[4
]}

Lawrence, N. ^{[5
]}

机构：

[1] Cauvery Coll Women, Dept Phys, Tiruchirappalli 620018, Tamil Nadu, India

[2] Govt Arts Coll Women Autonomous, Dept Phys, Pudukottai, India

[3] Anna Univ, Dept Chem, Tiruchirappalli 620024, Tamil Nadu, India

[4] Kalasalingam Univ, Dept Phys, Krishnankoil 626126, India

[5] St Josephs Coll Autonomous, Dept Phys, Tiruchirappalli 620018, Tamil Nadu, India

来源：

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY | 2015年 / 143卷

关键词：

Crystal growth; Semiorganic; FTIR; NMR; QUANTUM-CHEMICAL CALCULATIONS; X-RAY-DIFFRACTION; SINGLE-CRYSTAL; VIBRATIONAL-SPECTRA; CONFORMATION; FTIR; NMR; SPECTROSCOPY; COMPLEXES; TRANSPORT;

D O I：

10.1016/j.saa.2015.01.083

中图分类号：

O433 [光谱学];

学科分类号：

0703 ; 070302 ;

摘要：

Pyridine-1-ium-2-carboxylatehydrogenbromide (PHBr) crystal was grown from aqueous solution by slow evaporation method. The calculated lattice parameters of single crystal X-ray diffraction have shown the triclinic crystal system with centrosymmetric space group of P (i) over bar. The interaction of functional groups and their importance in their application was identified by FTIR spectral analysis. The material is optically transparent and the grown crystal is having lower cut off wavelength as 294 nm, thereby confirming the enhancement of non-linear optical (NLO) property and optical band gap of the PHBr have been determined as 2.49 eV by UV-Vis-NIR studies. The H-1 NMR spectrum confirms the molecular structure and the presence of different kinds of protons. (C) 2015 Elsevier B.V. All rights reserved.

引用

页码：192 / 199

页数：8

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