A set of representative hydrogen bonded dimers has been studied employing density
functional theory (DFT) in the Perdew, Burke, and Ernzerhof (PBE) generalized gradient …

The well‐known preference of the peptide bond for the trans conformation has been
attributed to steric effects. Here, we show that a proline residue with an N‐formyl group (Hi …

Asymmetric reductive Heck reaction of aryl halides is realized in high stereoselectivity.
Hydrogen‐bond donors, trialkylammonium salts in a glycol solvent, were used to promote …

The amino groups of thio‐and selenoamides can act as stronger hydrogen‐bond donors
than of carboxamides, despite the lower electronegativity of S and Se. This phenomenon …

Pure N, N-dimethylformamide (DMF) and DMF− water mixtures are studied by molecular
dynamics (MD) simulations. An OPLS all-atom force field is used for the simulation of DMF …

The coordination chemistry of lead (II) in the oxygen donor solvents water, dimethylsulfoxide
(dmso, Me2SO), N, N-dimethylformamide (dmf), N, N-dimethylacetamide (dma), N, N …

The strengths of hydrogen bonding interaction between formamide (FA) and thioformamide
(TFA) were investigated at the B3LYP level with the 6-311G (d, p), 6-31+ G (d, p), and 6 …

The structure of the solvated bismuth (III) ion in aqueous, dimethyl sulfoxide, N, N '-
dimethylpropyleneurea, and N, N-dimethylthioformamide solution has been studied by …

Metal halide perovskites have generated interest across many fields for the impressive
optoelectronic properties achievable in films produced using facile solution-processing …

It is a general and common practice to carry out single-crystal X-ray diffraction experiments
at cryogenic temperatures in order to obtain high-resolution data. In this report, we show that …