| Literature DB >> 33346262 |
Maria Enrica Di Pietro1, Oliver Hammond, Adriaan van den Bruinhorst, Alberto Mannu, Agilio Padua, Andrea Mele, Margarida Costa Gomes.
Abstract
The Deep Eutectic Solvents/Systems (DESs) choline chloride:urea (xChCl = 0.33) and choline chloride:glycolic acid (xChCl = 0.5) were investigated using viscosity-corrected 35Cl NMR spectroscopy and molecular dynamics simulations to probe the role of chloride as a function of water content. Three Cl- solvation regimes are revealed, with high-symmetry environments for pure and highly dilute DES, and an unusual low-symmetry interstitial region where the primary coordination sphere is most disordered.Entities:
Year: 2021 PMID: 33346262 DOI: 10.1039/d0cp05843b
Source DB: PubMed Journal: Phys Chem Chem Phys ISSN: 1463-9076 Impact factor: 3.676