Open Access
Open access
Journal of Molecular Liquids, volume 325, pages 115098

An(III)/Ln(III) solvent extraction: Theoretical and experimental investigation of the role of ligand conformational mobility

Publication typeJournal Article
Publication date2021-03-01
Quartile SCImago
Q1
Quartile WOS
Q1
Impact factor6
ISSN01677322, 18733166
Materials Chemistry
Electronic, Optical and Magnetic Materials
Physical and Theoretical Chemistry
Spectroscopy
Atomic and Molecular Physics, and Optics
Condensed Matter Physics
Abstract
Abstract The conformational mobility of organic molecules largely determines their properties. In this work, we used various theoretical and experimental methods to study the behavior of new complexing agents for trivalent f-elements. We presented a new method of conformational analysis and showed its relationship with complexation in solution. As a result, we proposed a new value Solvent-Corrected Preorganisation Energy (SCPE). The proposed value can be used to assess the efficiency of complexation in the target solvent.

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GOST Copy
Mitrofanov A. et al. An(III)/Ln(III) solvent extraction: Theoretical and experimental investigation of the role of ligand conformational mobility // Journal of Molecular Liquids. 2021. Vol. 325. p. 115098.
GOST all authors (up to 50) Copy
Mitrofanov A., Andreadi N., Matveev P. I., Zakirova G. G., Borisova N. E., Kalmykov S. N., Petrov V. An(III)/Ln(III) solvent extraction: Theoretical and experimental investigation of the role of ligand conformational mobility // Journal of Molecular Liquids. 2021. Vol. 325. p. 115098.
RIS |
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RIS Copy
TY - JOUR
DO - 10.1016/j.molliq.2020.115098
UR - https://doi.org/10.1016%2Fj.molliq.2020.115098
TI - An(III)/Ln(III) solvent extraction: Theoretical and experimental investigation of the role of ligand conformational mobility
T2 - Journal of Molecular Liquids
AU - Mitrofanov, Artem
AU - Andreadi, Nikolai
AU - Matveev, Petr I
AU - Zakirova, Gladis G
AU - Borisova, Nataliya E.
AU - Kalmykov, Stepan N.
AU - Petrov, Vladimir
PY - 2021
DA - 2021/03/01 00:00:00
PB - Elsevier
SP - 115098
VL - 325
SN - 0167-7322
SN - 1873-3166
ER -
BibTex
Cite this
BibTex Copy
@article{2021_Mitrofanov
author = {Artem Mitrofanov and Nikolai Andreadi and Petr I Matveev and Gladis G Zakirova and Nataliya E. Borisova and Stepan N. Kalmykov and Vladimir Petrov},
title = {An(III)/Ln(III) solvent extraction: Theoretical and experimental investigation of the role of ligand conformational mobility},
journal = {Journal of Molecular Liquids},
year = {2021},
volume = {325},
publisher = {Elsevier},
month = {mar},
url = {https://doi.org/10.1016%2Fj.molliq.2020.115098},
pages = {115098},
doi = {10.1016/j.molliq.2020.115098}
}
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