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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Fulem, Michal
University of Chemistry and Technology
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (6/6 displayed)
- 2023Heat Capacities of N-Acetyl Amides of Glycine, L-Alanine, L-Valine, L-Isoleucine, and L-Leucinecitations
- 2023Solid–Liquid Equilibrium in Co-Amorphous Systems: Experiment and Predictioncitations
- 2020A combined thermodynamic and crystallographic study of 1,3-diisopropylnaphthalenecitations
- 2020Impact of Hot-Melt Extrusion Processing Conditions on Physicochemical Properties of Amorphous Solid Dispersions Containing Thermally Labile Acrylic Copolymercitations
- 2020Glucose-modified carbosilane dendrimers: Interaction with model membranes and human serum albumincitations
- 2020Heat Capacities of l -Alanine, l -Valine, l -Isoleucine, and l -Leucine: Experimental and Computational Studycitations
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article
A combined thermodynamic and crystallographic study of 1,3-diisopropylnaphthalene
Abstract
The thermodynamic properties and phase behaviour of 1,3-diisopropylnaphthalene were studied for the first time using static vapour pressure measurements, Tian-Calvet calorimetry, and differential scanning calorimetry (DSC). Polymorphic behaviour of the compound was detected and studied in detail by combination of DSC and variable-temperature X-ray powder diffraction. The crystal structure of the disordered metastable phase was obtained using a single-crystal X-ray diffraction for the first time. The experimental study was supplemented by calculating thermodynamic properties in the ideal-gas state using a combination of statistical thermodynamics and quantum-chemical calculations. Recommended vapour pressure equation was derived by simultaneous treatment of vapour pressures, experimental heat capacities of the condensed phases, calculated ideal-gas heat capacities, and temperature and enthalpy fusion, assuring their mutual thermodynamic consistency. (c) 2020 Elsevier Ltd.