Systematic Evaluation of a Cluster-Continuum-Model Workflow to Compute the Free Energies of Solvation of Ions in Different Solvents. [PDF]
Lehmann M, Jameel F, Kaupp M.
europepmc +1 more source
Solvent Effects on the Photophysical Properties of Unexplored Imidazo[1,2‑<i>a</i>]pyridine Derivatives. [PDF]
Justino Garcia Praciano VH +4 more
europepmc +1 more source
Synthesis of Ethyl Methyl Carbonate: Past, Present, and Future
Ethyl methyl carbonate (EMC) is the simplest asymmetric organic carbonate, with properties between dimethyl (DMC) and diethyl (DEC) carbonate, considered a unique green liquid organic compound for lithium batteries (electrolyte) and gasoline blending (octane enhancer additive), among other uses. In accordance, the chemical production of EMC is expected
Belén Lerma‐Berlanga +1 more
wiley +1 more source
Reaction of metals with benzenediazonium tetrafluoroborate in aprotic solvents
Koval’chuk Eugen +5 more
doaj +1 more source
Density functional theory insights into the solvent effect on the binding energies of Cd<sup>2+</sup> in functionalized MOFs. [PDF]
Hoa VT.
europepmc +1 more source
Enhancing Biogenic Formic Acid Production in the Modified OxFA Process by Acetonitrile Addition
In this study, the beneficial effect of using acetonitrile as a co‐solvent in the modified OxFA process is shown, outperforming methanol, demonstrating improved reaction kinetics combined with high selectivity for the HPA‐2 (H5PV2Mo10O40) catalyzed oxidation of xylose to FA.
Jan‐Dominik H. Krueger +7 more
wiley +1 more source
Decoding Solvent Effects in Electrocatalytic Biomass Valorization: Levulinic Acid to γ‑Valerolactone. [PDF]
Vilariño P +3 more
europepmc +1 more source
This work establishes a correlation between solvent properties and the charge transport performance of solution‐processed organic thin films through interpretable machine learning. Strong dispersion interactions (δD), moderate hydrogen bonding (δH), closely matching and compatible with the solute (quadruple thiophene), and a small molar volume (MolVol)
Tianhao Tan, Lian Duan, Dong Wang
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Proton Solvation in Water and Selected Organic Solvents: A Critical Assessment of Experimental and Theoretical Approaches to Extend the Solvent-Independent Unified Acidity Scale. [PDF]
Stroh R +4 more
europepmc +1 more source
A green chiral HPLC method was developed and validated for the determination of lumefantrine enantiomers. The method employs ethanol as a mobile phase as a sustainable and efficient alternative to hexane. The chiral recognition mechanism and elution order of the enantiomers were investigated using electronic circular dichroism and molecular docking ...
Amanda Mohr +4 more
wiley +1 more source

