Organic compounds labeled with hydrogen isotopes play a crucial role in numerous areas,
from materials science to medicinal chemistry. Indeed, while the replacement of hydrogen by …

Owing to the unknown correlation of a metal's ligand and its resulting preferred speciation in
terms of oxidation state, geometry, and nuclearity, a rational design of multinuclear catalysts …

The chemistry community is currently witnessing a surge of scientific discoveries in organic
chemistry supported by machine learning (ML) techniques. Whereas many of these …

The automated construction of datasets has become increasingly relevant in computational
chemistry. While transition-metal catalysis has greatly benefitted from bottom-up or top-down …

The chemical sciences are witnessing an influx of statistics into the catalysis literature.
These developments are propelled by modern technological advancements that are leading …

A palladium-catalyzed deuterated formylation of aryl sulfonium salts is prepared
conveniently from readily available arenes, which enables the expedient synthesis of a …

The recent surge in deuterated pharmaceutical compounds has created an urgent demand
for new synthetic tools that allow facile access to D-containing building blocks. As one of the …

The synthesis of high-value-added C1-deuterated aldehydes would improve the availability
of deuterated lead compounds for deuterium-labeled drug discovery. Herein, we develop a …

Secondary-sphere interactions are often harnessed to control reactivity and selectivity in
organometallic and enzymatic catalysis. Yet, such strategies have only recently been …

Phthalimidine finds wide pharmaceutical applications and its deuterated derivative is
supposed to exhibit enhanced stability towards metabolism. In this work, an …