The fully relaxed single-bond torsional potentials in typical conjugated systems were
evaluated with the aid of ab initio self-consistent-field and Møller− Plesset second-order …

Residual dipolar couplings arising from small degrees of align- tein–DNA complexes, as
opposed to proteins alone, is sim-ment of molecules in a magnetic field provide unique long …

Contrary to other recent reports, Pauling's original electronegativity equation, applied as
Pauling specified, describes quite accurately homolytic bond dissociation enthalpies of …

A number of thermally and optically stable, bis-dipolar chiral molecules based on two
geometries of the binaphthol (BN) system with different acceptors/substituents have been …

Several small paramagnetic complexes combine large hyperfine NMR shifts with large
magnetic anisotropies. The latter are a prerequisite for single molecule magnet (SMM) …

The 1 H NMR spectra of partially aligned molecules become rapidly complex with the
increase in the number of interacting spins and the decrease in the symmetry of the …

High‐spin FeII–alkyl complexes with bis (pyridylimino) isoindolato ligands were synthesized
and their paramagnetic 1H and 13C NMR spectra were analyzed comprehensively. The …

The twisting ability of a novel series of bridged binaphthol derivatives with substituents of
various lengths and chemical nature in the 6, 6-positions, recently synthesized and used as …

The dynamic structure of styrene has been studied with the goal of obtaining detailed
information on the internal rotation parameters. A potential energy surface has been …

The molecular structures of styrene and (Z)-β-bromostyrene have been studied in the gas
phase at nozzle temperatures of 303 and 338 K respectively. For both molecules the …