Synthesis, crystal structure, physicochemical characterization, and dielectric properties of a new organic chloride salt, (C3H7N6)Cl•0.5H2O

被引:8
作者
Mesbeh, Radhia [1 ]
Hamdi, Besma [1 ]
Zouari, Ridha [1 ]
机构
[1] Fac Sci Sfax, Lab Sci Mat & Environm, BP 1171, Sfax 3000, Tunisia
关键词
Crystal structure; Dielectric measurements; Vibrational study; Optical properties; Differential scanning calorimetric (DSC); Hirshfeld surface; INFRA-RED SPECTRUM; OPTICAL-PROPERTIES; ELECTRICAL-PROPERTIES; VIBRATIONAL-SPECTRA; MAGNETIC-PROPERTIES; HYBRID COMPOUND; CONDUCTIVITY; SPECTROSCOPY; TRANSITIONS; TRIAZINE;
D O I
10.1007/s11581-019-03092-4
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The crystallization of (C3H7N6)Cl center dot 0.5H(2)O is made by slow evaporation at room temperature. It was found to crystallize in the monoclinic system, C2/m space group, with the following lattice parameters: a = 12.4124 (5) angstrom, b = 17.6339 (7) angstrom, c = 7.1193 (3) angstrom, beta = 115.057 (2)degrees, Z = 4, and V = 1411.61 (10) angstrom(3). The cohesion in (C3H7N6)Cl center dot 0.5H(2)O is provided by three types of hydrogen bonds, O-H horizontal ellipsis Cl, N-H horizontal ellipsis O, N-H horizontal ellipsis Cl, and N-H horizontal ellipsis N. Furthermore, the room temperature IR and Raman spectra of the title compound were recorded and analyzed on the basis of literature data. The optical study was also investigated by UV-Vis absorption. The differential scanning calorimetric (DSC) and dielectric study of this compound has been measured. The percentages of hydrogen bonding interactions are analyzed by fingerprint plots of Hirshfeld surface.
引用
收藏
页码:6147 / 6160
页数:14
相关论文
共 40 条
[1]   ac conductivity analysis and dielectric relaxation behaviour of NaNO3-Al2O3 composites [J].
Anantha, PS ;
Hariharan, K .
MATERIALS SCIENCE AND ENGINEERING B-SOLID STATE MATERIALS FOR ADVANCED TECHNOLOGY, 2005, 121 (1-2) :12-19
[2]  
[Anonymous], 1986, PROGRAM CRYSTAL STRU
[3]   Structural and vibrational spectral investigations of melaminium maleate monohydrate by FTIR, FT-Raman and quantum chemical calculations [J].
Arjunan, V. ;
Kalaivani, M. ;
Marchewka, M. K. ;
Mohan, S. .
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2013, 107 :90-101
[4]   Crystal structure, vibrational studies, optical properties and DFT calculations of 2-amino-5-diethyl-aminopentanium tetrachlorocadmate (II) [J].
Baklouti, Yosra ;
Chaari, Najla ;
Feki, Habib ;
Chniba-Boudjada, Nassira ;
Zouari, Fatma .
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2015, 136 :397-404
[5]   Structural and impedance properties of KBa2V5O15 ceramics [J].
Behera, Banarji ;
Nayak, P. ;
Choudhary, R. N. P. .
MATERIALS RESEARCH BULLETIN, 2008, 43 (02) :401-410
[6]   Electrical properties and equivalent circuit of trimethylammonium monobromodichloromercurate [J].
Ben Rhaiem, A ;
Guidara, K ;
Gargouri, M ;
Daoud, A .
JOURNAL OF ALLOYS AND COMPOUNDS, 2005, 392 (1-2) :68-71
[7]   PATTERNS IN HYDROGEN BONDING - FUNCTIONALITY AND GRAPH SET ANALYSIS IN CRYSTALS [J].
BERNSTEIN, J ;
DAVIS, RE ;
SHIMONI, L ;
CHANG, NL .
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 1995, 34 (15) :1555-1573
[8]  
Brandenburg K., 2001, DIAMOND VERSION 2 1
[9]   Electrical properties of Li2BiV5O15 ceramics [J].
Das, P. S. ;
Chakraborty, P. K. ;
Behera, Banarji ;
Choudhary, R. N. P. .
PHYSICA B-CONDENSED MATTER, 2007, 395 (1-2) :98-103
[10]   Measurement and ab initio modeling of the inelastic neutron scattering of solid melamine -: Evidence of the anisotropy in the external modes spectrum [J].
Fernández-Liencres, MP ;
Navarro, A ;
López-González, JJ ;
Fernández-Gómez, M ;
Tomkinson, J ;
Kearley, GJ .
CHEMICAL PHYSICS, 2001, 266 (01) :1-17