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Published in 2017 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2017.05.044
Abstract: Abstract In this paper, five novel cholinium-based organic magnetic ionic liquids (MILs) were synthesized. The carbon chain links to the nitrogen atom from cationic nucleus. The MILs were comprehensively identified by FT-IR, HPLC, UV–Vis, 1H…
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Keywords:
novel cholinium;
cholinium based;
physical properties;
organic magnetic ... See more keywords
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Published in 2019 at "Journal of Molecular Liquids"
DOI: 10.1016/j.molliq.2019.111641
Abstract: Abstract Solvation free energy of H2S in five cholinium-based amino acid ILs was computed using Bennet Acceptance Ratio (BAR) method under molecular dynamics (MD) simulation. From the predicted free energy, degree of removal of acid…
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Keywords:
thermodynamics;
energy;
cholinium based;
acid ... See more keywords
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Published in 2021 at "Green Chemistry"
DOI: 10.1039/d1gc01622a
Abstract: Herein we report the dissolution mechanism of lignin in cholinium-based ionic liquids by molecular dynamics simulations. Multiple hydrogen bonds, longer HB lifetimes, and higher pKa of [Ch][Lys] makes it a better solvent for lignin than…
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Keywords:
cholinium based;
towards understanding;
understanding delignification;
ionic liquids ... See more keywords
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Published in 2021 at "Sustainability"
DOI: 10.3390/su13137509
Abstract: Spent coffee grounds (SCGs) are a waste product with no relevant commercial value. However, SCGs are rich in extractable compounds with biological activity. To add value to this coffee byproduct, water and aqueous solutions of…
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Keywords:
cholinium based;
cholinium;
aqueous solutions;
solutions cholinium ... See more keywords