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Mostrando ítems 1-10 de 2036
On the hydrogen bonding between N-methylformamide and acetone and tetrahydrofuran
(Elsevier B.V., 2014-04-15)
Liquid mixtures of N-methylformamide (NMF)-acetone (ACT) and NMF-tetrahydrofuran (THF) 20 mol% NMF have been investigated using Monte Carlo simulations, aiming to obtain new details on the hydrogen bonding donation of the ...
Theoretical studies on hydrogen bonding interactions: From small clusters to the liquid phase
(2011)
This article discusses some methodological aspects and applications of hydrogen bonding interactions in molecular aggregates, as well as in liquids, that have currently been considered in the literature. First, the concept ...
Strong hydrogen bonds in dicarboxylics acids and aromatics diamines.
(Soc Brasileira QuimicaSao PauloBrasil, 2000)
Ligações hidrogênio fortes em ácidos dicarboxílicos e diaminas aromáticasStrong hydrogen bonds in dicarboxylics acids and aromatics diamines
(Sociedade Brasileira de Química, 2000)
Physical meaning of the QTAIM topological parameters in hydrogen bonding
(Springer, 2014-10)
This work examined the local topological parameters of charge density at the hydrogen bond (H-bond) critical points of a set of substituted formamide cyclic dimers and enolic tautomers. The analysis was performed not only ...
Conformational analysis and intramolecular interactions in monosubstituted phenylboranes and phenylboronic acids
(Beilstein-institutFrankfurt Am MainAlemanha, 2013)
Understanding the nature of bonding interactions in the carbonic acid dimers
(Springer, 2019-01)
Carbonic acid dimer, (CA)2, (H2CO3)2, helps to explain the existence of this acid as a stable species, different to a simple sum between carbon dioxide and water. Five distinct, well characterized types of intermolecular ...