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RESEARCH PRODUCT

Structural characterization, thermal, dielectric, vibrational properties and molecular dynamics of (C5H5NH)3BiCl6

Grażyna BatorJakub BaranJ. TarasiewiczJacek ZaleskiRyszard JakubasWojciech Medycki

subject

PermittivityPhase transitionOrganic ChemistryAnalytical chemistryInfrared spectroscopyDielectricTriclinic crystal systemAnalytical ChemistryInorganic ChemistryCrystallographychemistry.chemical_compoundDifferential scanning calorimetrychemistryPhase (matter)PyridiniumSpectroscopy

description

Abstract (C5H5NH)3BiCl6 crystallizes at room temperature in the triclinic space group P 1 ¯ . The crystal is built up of the separated BiCl 6 3 - octahedral anions and pyridinium cations. Differential scanning calorimetry (DSC) and dilatometric measurements disclose structural phase transition of first-order type at 265/302 K (cooling/heating). The dielectric investigations reveal a step-wise change of the electric permittivity at Tc characteristic of the crystals with the high-temperature plastic-like phase. Temperature-dependent infrared spectra for polycrystalline samples have been taken between 20 and 306 K to clarify the cation dynamics contribution to the mechanism of the phase transition. The modes assigned to the deformation vibration of the NH+ group in the pyridinium ring appear to be the most sensitive to the phase transition. The possible molecular motions of the C5H5NH+ cations are studied by the proton magnetic resonance (1H NMR).

https://doi.org/10.1016/j.molstruc.2009.05.034