Influence of the Alkyl Chain Length on the Low Temperature Phase Transitions of Imidazolium Based Ionic Liquids

التفاصيل البيبلوغرافية
العنوان: Influence of the Alkyl Chain Length on the Low Temperature Phase Transitions of Imidazolium Based Ionic Liquids
المؤلفون: Adriano Cimini, Annalisa Paolone, Francesco Trequattrini, Oriele Palumbo
المصدر: Journal of solution chemistry (2021): 1–17. doi:10.1007/s10953-021-01079-2
info:cnr-pdr/source/autori:Cimini A.; Palumbo O.; Trequattrini F.; Paolone A./titolo:Influence of the Alkyl Chain Length on the Low Temperature Phase Transitions of Imidazolium Based Ionic Liquids/doi:10.1007%2Fs10953-021-01079-2/rivista:Journal of solution chemistry/anno:2021/pagina_da:1/pagina_a:17/intervallo_pagine:1–17/volume
بيانات النشر: Kluwer Academic Publishers [etc.], [Hingham, MA, etc.], Stati Uniti d'America, 2021.
سنة النشر: 2021
مصطلحات موضوعية: Phase transition, Biophysics, Infrared spectroscopy, 02 engineering and technology, Dihedral angle, 010402 general chemistry, 01 natural sciences, Biochemistry, law.invention, chemistry.chemical_compound, law, Phase (matter), Alkyl chain, Ionic liquid, Phase transitions, Rotational isomerism, Physical and Theoretical Chemistry, Crystallization, Molecular Biology, Conformational isomerism, Alkyl, chemistry.chemical_classification, Chemistry, 021001 nanoscience & nanotechnology, 0104 chemical sciences, Crystallography, Infrared spectroscopy · Ionic liquid · Rotational isomerism · Alkyl chain · Phase transitions, 0210 nano-technology
الوصف: The effects induced by alkyl chain length on the thermal phase behavior for a series of imidazolium based ionic liquids (ILs) containing the anion bis(trifluoromethanesulfonyl)imide (TFSI) were investigated by infrared spectroscopy combined with density functional theory (DFT) calculations. In agreement with previous results on pyrrolidinium and ammonium based ionic liquids sharing the TFSI anion, our study shows that with increasing the length of the alky chain only the less stable cis-TFSI is retained in the solid state, while for shorter chain the trans-TFSI predominates in the crystalline phase. Also, we examined the remarkable effect on the packing efficiency due to the addition of 2-hydroxyethyl group on the imidazolium cation ring, reporting that the absence of crystallization is observed in correspondence with the presence of both the conformers of TFSI in the whole temperature range (150–325 K). Moreover, a detailed study of 1-ethyl-2,3-dimethylimidazolium-TFSI (EDMIM-TFSI) reveals the existence of cation rotational isomerism. In the liquid phase both planar (P) and non-planar (Np) conformers are present in the equilibrium, while a conformational change for the CNCC dihedral angle of the EDMIM cation leads to stabilize the formation of the more stable non-planar geometry in the crystalline phase.
اللغة: English
DOI: 10.1007/s10953-021-01079-2
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1be308e2035bb5b019db62aae8d115de
https://publications.cnr.it/doc/454231
Rights: RESTRICTED
رقم الانضمام: edsair.doi.dedup.....1be308e2035bb5b019db62aae8d115de
قاعدة البيانات: OpenAIRE
الوصف
DOI:10.1007/s10953-021-01079-2