This contribution explains how the topological methods of analysis of the electron density
and related functions such as the electron localization function (ELF) and the electron …

Electronic delocalization is invoked in many textbooks as the driving force of several
fundamental phenomena such as conjugation, hyperconjugation, and aromaticity. These …

Data on the electronic structure and redox, magnetic, luminescent, nonlinear optical and
catalytic properties of tri-and tetranuclear molybdenum and tungsten chalcogenide clusters …

Herein, we report a straightforward protocol for the preparation of N, N‐dimethylated amines
from readily available nitro starting materials using formic acid as a renewable C1 source …

The catalytic hydrodefluorination (HDF) of pentafluoropyridine in the presence of arylsilanes
is catalyzed by the tungsten and molybdenum (IV) cluster hydrides of formula [M3S4H3 …

Herein, we report results of calculations based on density functional theory (BP86/TZVP) of a
set of isatin‐Schiff base copper (II) and related complexes, 1‐12, that have shown significant …

We have previously shown that cyclopentadienyl (CpR)-supported [Mo3S4] platforms
capture and stabilize halides of hetero-metals (M) under reducing conditions to give …

A previous report introduced a new series of cationic nickel (II) complexes ligated by PCP-
type pincer ligands featuring a charge-bearing imidazoliophosphine binding moiety and …

The electronic structure of heterometallic cubane-type clusters with core {Mo 3 S 4
M′}(M′= Cu+, Ni 0, Pd 0) was investigated by the Atoms in Molecules and Electron …

Charge state studies of compounds [Mo 3 S 4 (tu) 8 (H 2 O)] Cl 4· 4H 2 O (1),[Mo 3 S 4 Cl 3
(dbbpy) 3] Cl· 5H 2 O (2),[Mo 3 S 4 (CuCl) Cl 3 (dbbpy) 3][CuCl 2](3), containing {Mo 3 S 4} …