Computational chemistry provides a versatile toolbox for studying mechanistic details of
catalytic reactions and holds promise to deliver practical strategies to enable the rational in …

Iron porphyrin-based molecular catalysts can electrocatalyze CO2 reduction to CO at nearly
100% selectivity in water. Nevertheless, the associated active sites and reaction …

Copper-catalysed radical-relay reactions that employ N-fluorobenzenesulfonimide (NFSI) as
the oxidant have emerged as highly effective methods for C (sp3)–H functionalization …

Defined arrays of transition metal ions embedded in tailored polydentate ligand scaffolds
allow for a systematic design of their physical properties. Such molecular strings of closed …

Reaction mechanisms of electrocatalytic CO 2 reduction into CO over Co or Fe complexes
were examined using gas diffusion electrodes to meet the requirement of high current …

Hydrated transition metal ions are prototypical systems that can be used to model properties
of transition metals in complex chemical environments. These seemingly simple systems …

Oxygen-activated copper zeolites are capable of selectively converting methane to methanol
at mild conditions, using a mono-oxygen bridged Cu (II) site [CuOCu] 2+ as the active core …

Electron transporting (n-type) polymeric mixed conductors are an exciting class of materials
for devices with aqueous electrolyte interfaces, such as bioelectronic sensors, actuators, and …

A variety of biaryl polyketides exhibit remarkable bioactivities. However, their synthetic
accessibility is often challenging. Herein, the enantioselective preparation and synthetic …

In recent years, the electronic structures of organocuprates in general and the complex [Cu
(CF3) 4]− in particular have attracted significant interest. A possible key indicator in this …