Crystal structures, Hirshfeld surface analysis, thermal behavior and dielectric properties of a new organic–inorganic hybrid [C6H10(NH3)2]Cu2Cl8

A novel organic-inorganic hybrid material (C 6 H 10 N 2)(Hg 2 Cl 5) 2 .3H 2 O has been prepared under hydrothermal conditions. It is characterized by single crystal X-ray diffraction, thermal analysis and spectroscopy measurements (IR, Raman and NMR). The structural analysis revealed that this material crystallizes in the monoclinic system (C 2/c space group) with the following unit cell parameters a = 19.6830(15) Å, b =18.1870(15) Å, c = 6.8567(6) Å, β = 93.224(3) ° and Z=4. According to the data collected at 150(2) K, the refinement converged to R= 0.0296. The atomic arrangement can be described as an alternation of cationic [C 6 H 10 N 2 ] 2+ .H 2 O and anionic [Hg 2 Cl 5 ]layers along the c axis. In fact, a three-dimensional cohesion, which leads to these peridinium complexes, involves (N-H***Cl) (N-H***O) (O-H***O) and π-π interactions. Furthermore the FT-IR, Raman and NMR-MAS confirm the presence of organic and inorganic entities. Finally, the differential scanning calorimetry revealed several endothermic peaks.

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Synthesis, PXRD structural determination, Hirshfeld surface analysis and DFT/TD-DFT investigation of 3N-ethyl-2N’-(2-ethylphenylimino) thiazolidin-4-one

Belkafouf

Baara

Altomare

et al. 2019

Journal of Molecular Structure

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Crystal structures, Hirshfeld surface analysis, thermal behavior and dielectric properties of a new organic–inorganic hybrid [C6H10(NH3)2]Cu2Cl8

Cited by 9 publications

References 30 publications

Synthesis, crystal structure, photoluminescence properties of organic-inorganic hybrid materials based on ethylenediamine bromide

Synthesis, crystal structure, photoluminescence properties of organic-inorganic hybrid materials based on ethylenediamine bromide

Ionic organic-inorganic (C6H10N2) (Hg2Cl5)2·3H2O compound: Structural study, hirshfeld surface, thermal behavior and spectroscopic studies

Synthesis, PXRD structural determination, Hirshfeld surface analysis and DFT/TD-DFT investigation of 3N-ethyl-2N’-(2-ethylphenylimino) thiazolidin-4-one

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