… dihydrogen bond found in solid BH3NH3 using a periodic quantum mechanical modeling
approach, where the … In conclusion, we have performed PW-DFT calculations to …

… of a dihydrogen-bonded solid. We show the spectroscopic behavior of dihydrogen bonds …
to that found in moderately strong conventional hydrogen bonds. We also report a pressure-…

… Similarly, the BH bonds were either exo-BH bonds of boron … for the existence of dihydrogen
bonds in boraneamines and … as the archetype of a dihydrogen bond, we felt we needed to …

… As for the complexes in which only dihydrogen bonds appear the strength of dihydrogen
bonds ranges from 17.9 to 18.9 kJ mol −1 at B3LYP/6-311++g(d,p) level. Binding energies …

… In conclusion, the analysis presented herein shows that the cooperative dihydrogen
interactions are not the main organizing factors in the molecular aggregations affecting the bond …

… the “dihydrogen bond”. What follows is a deuterium NMR spectroscopic study of solid BD 3
… Our goal is to gain some insight into the strengths of the intermolecular interactions in solid …

… Cluster formation of ammonia borane (NH 3 BH 3 ) driven by noncovalent H···H dihydrogen
… monomers occurs through H···H dihydrogen bonding. The extent of electron donation is …

… This is because although the dihydrogen bond is weaker than the classic hydrogen bond, …
not only a dihydrogen bond with the BH 3 group, but also a classic hydrogen bond with the first …

… dihydrogen bonding, in accord with the electrostatic bonding … particularly strong dihydrogen
bonding to H trans to NO.[15] … B dihydrogen bond including the crystal structure of BH3NH3 …

… The bond orders show substantial bond formation and breakage in the transition state …
TSet-b show a partially formed dihydrogen bond, which is additionally stabilized by electrostatic …