Scalable modeling of multi-spin ensembles in SABRE hyperpolarization: a symmetry-based framework for zero and ultralow fields. [PDF]
Markelov D +4 more
europepmc +1 more source
Late‐Stage Modification of Halotryptophan‐Containing Peptides Via Negishi Cross‐Coupling
Negishi cross‐coupling provides access to the late‐stage functionalization of bromotryptophan‐containing peptides under comparatively mild conditions and is applicable to a range of peptide substrates in the investigated model systems. The examined alkyl iodides and variation of N‐terminal residues demonstrate the feasibility of the transformation in a
Laura Cerveson +2 more
wiley +1 more source
Simple s-block metal hydrides for selective hydrogenation of quinoline compounds. [PDF]
Zhang S +8 more
europepmc +1 more source
Organo‐functionalized molecular molybdenum sulfides were synthesized using bidentate N‐donor ligands and investigated as light‐driven homogeneous hydrogen evolution reaction (HER) catalysts. Trends observed in the HER activity of these catalysts were elucidated by combining photophysical, electrochemical and computational studies.
Moritz Jahn +9 more
wiley +1 more source
Hydrogen Embrittlement Behavior of Laser Melting Deposited Ti-6Al-4V Alloy with Different Build Orientations. [PDF]
Jiang K +8 more
europepmc +1 more source
Oxidative Generation and Reactivity of the Cyclopropyl Radical From a Martin Silicate
A photoredox strategy employing Martin silicates enables the oxidative generation and controlled capture of cyclopropyl radicals, including the naked one, long considered challenging intermediates. The method affords functionalized cyclopropanes through both Giese‐type additions and dual nickel/photoredox C(sp3)−C(sp2) cross‐couplings.
Amal Lakhal +3 more
wiley +1 more source
First-principles study of novel Cs<sub>2</sub>LuCoH<sub>6</sub> and Cs<sub>2</sub>LuZnH<sub>6</sub> double hydride perovskites for hydrogen storage applications. [PDF]
Almufarij RS +9 more
europepmc +1 more source
Catalyst‐Free Selective Reduction of Nitrogen Dioxide to Nitric Oxide
Common main group reductants selectively convert nitrogen dioxide to nitric oxide in a catalyst‐free manner. Computational studies suggest divergent reaction pathways depending on the reductant employed. Where boranes and silanes proceed via a two‐electron process, and hydrogen surrogates undergo stepwise one‐electron processes.
Awais W. Seyyad +3 more
wiley +1 more source
Si-O Bond Formation Mediated by an Osmium-Polyhydride: Dehydrogenative Silylation of Alcohols and Tandem Hydrosilylation/Dehydrogenative Silylation of Salicylaldehydes. [PDF]
Alli IV, Oñate E, Oliván M.
europepmc +1 more source
Germylium Catalyzed Dehydrofluorination Reactions of Fluorinated Alkanes
Dehydrofluorination reactions of fluorinated alkanes catalyzed by germylium ions are reported. Computational studies of the mechanism revealed an E2 type mechanism involving a germane as a base to facilitate olefin formation in competition with an SN2 mechanism for hydrodefluorination.
Julie Borel +3 more
wiley +1 more source

