Low cost prediction of relative stabilities of hydrogen bonded complexes from atomic multipole moments for overly short intermolecular distances

2013 ◽  
Vol 34 (21) ◽  
pp. 1797-1799 ◽  
Author(s):  
Wiktor Beker ◽  
Karol M. Langner ◽  
Edyta Dyguda-Kazimierowicz ◽  
Mikołaj Feliks ◽  
W. Andrzej Sokalski
Keyword(s):  
Low Cost ◽  
Multipole Moments ◽  
Cost Prediction ◽  
Relative Stabilities ◽  
Intermolecular Distances ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Theoretical study of hydrogen bonding interactions in substituted nitroxide radicals

2021 ◽  
Author(s):  
Thufail M. Ismail ◽  
Neetha Mohan ◽  
P. K. Sajith
Keyword(s):  
Hydrogen Bonding ◽  
Interaction Energy ◽  
Electrostatic Potential ◽  
Molecular Electrostatic Potential ◽  
Theoretical Study ◽  
Nitroxide Radicals ◽  
Hydrogen Bonding Interactions ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Interaction energy (Eint) of hydrogen bonded complexes of nitroxide radicals can be assessed in terms of the deepest minimum of molecular electrostatic potential (Vmin).

Hydrogen‐Bonded Complexes of Star Polymers

2021 ◽  
pp. 2100097
Author(s):  
Aliaksei Aliakseyeu ◽  
Elena E. Dormidontova ◽  
Svetlana A. Sukhishvili
Keyword(s):  
Star Polymers ◽  
Bonded Complexes ◽  
Hydrogen Bonded

Neon matrix induced perturbations of weak hydrogen-bonded complexes.

2003 ◽  
Vol 5 (24) ◽  
pp. 5365 ◽  
Author(s):  
M. Goubet ◽  
P. Asselin ◽  
P. Soulard ◽  
J. P. Perchard
Keyword(s):  
Bonded Complexes ◽  
Hydrogen Bonded

HYDROGEN BONDING IN DIASTEREOISOMERIC α-β AMINOALCOHOLS: A REINVESTIGATION OF THE EPHEDRINES BY N.M.R

1960 ◽  
Vol 38 (1) ◽  
pp. 125-130 ◽  
Author(s):  
James B. Hyne
Keyword(s):  
Hydrogen Bonding ◽  
Polar Solvents ◽  
Relative Stabilities ◽  
Hydrogen Bonded

The results of an n.m.r. study of the diastereoisomeric ephedrine and ψ-ephedrine molecules in non-polar solvents are interpreted and discussed in terms of the relative stabilities of the intramolecularly hydrogen-bonded conformers.

A chemometrical study of intermolecular properties of hydrogen-bonded complexes formed by C2H4O⋅⋅⋅HX and C2H5N⋅⋅⋅HX with X = F, CN, NC, and CCH

2008 ◽  
Vol 15 (4) ◽  
pp. 421-432 ◽  
Author(s):  
Boaz G. Oliveira ◽  
Regiane C. M. U. Araújo ◽  
Antônio B. Carvalho ◽  
Mozart N. Ramos
Keyword(s):  
Bonded Complexes ◽  
Hydrogen Bonded
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