Recently, substantial efforts had been made in the field of synthetic iron compounds as
structural and functional models of the hydrogenase enzyme active site for the purpose of …

The field of proton reduction by iron complexes without thiolate bridging ligand (s) in
homogeneous systems is reviewed. Till date electrocatalytic proton reduction by iron …

Environmentally sustainable hydrogen‐evolving electrocatalysts are key in a renewable fuel
economy, and ligand‐based proton and electron transfer could circumvent the need for …

Here we report the electrocatalytic reduction of protons to hydrogen by a novel S2P2
coordinated nickel complex,[Ni (bdt)(dppf)](bdt= 1, 2-benzenedithiolate, dppf= 1, 1′-bis …

We discuss the possibility of exploiting local minima of the molecular electrostatic potential
for locating protonation sites in molecules in a fully automated manner. We implement and …

A series of cobalt bis (benzenedithiolate) complexes with varying benzenedithiolate
(general abbreviation: bdt2–) ring substitutions (S2C6X42–) were prepared and adsorbed …

Enzymes, as the result from natural evolution, have greatly inspired chemists to design high-
performance catalysts for various reactions. For such design, theoretical calculations under …

The design, syntheses and characteristics of metal carbonyl complexes with aromatic
dithiolate linkers reported as bioinspired hydrogenase catalytic site models are described …

Phosphorus-based Mannich-type reactions (phospha-Mannich reactions) of primary or
secondary phosphines with carbonyl compounds and amines (R2NH, RNH2, and NH3) …

New entries to the [Ru (Cp/Cp*)(PR2NR′ 2)(MeCN)] PF6 catalyst family were synthesized,
including a Cp complex (R= Cy; R′= Ph) and two Cp* complexes (R= Cy, Ph; R′= Ph) …