Topological analysis of hydrogen bonding interactions involving C-H...O bonds

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A topological analysis of two model systems in which different C-H⋯O hydrogen bonds exist is performed in order to characterize them. It is found that it is necessary to analyze the topological properties of the acceptor atom involved in the hydrogen bond since several parameters are qualitatively d...

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Autores principales: Sosa, G.L., Peruchena, N., Contreras, R.H., Castro, E.A.
Formato: JOUR
Materias:
Hydrogen bonding
Topological analysis
Acceso en línea:http://hdl.handle.net/20.500.12110/paper_01661280_v401_n1-2_p77_Sosa
Aporte de:
Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires
id todo:paper_01661280_v401_n1-2_p77_Sosa
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spelling todo:paper_01661280_v401_n1-2_p77_Sosa2023-10-03T15:03:23Z Topological analysis of hydrogen bonding interactions involving C-H...O bonds Sosa, G.L. Peruchena, N. Contreras, R.H. Castro, E.A. Hydrogen bonding Topological analysis A topological analysis of two model systems in which different C-H⋯O hydrogen bonds exist is performed in order to characterize them. It is found that it is necessary to analyze the topological properties of the acceptor atom involved in the hydrogen bond since several parameters are qualitatively different in both complexes. This behaviour seems to suggest a way of identifying these bonds. © 1997 Elsevier Science B.V. Fil:Contreras, R.H. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. JOUR info:eu-repo/semantics/openAccess http://creativecommons.org/licenses/by/2.5/ar http://hdl.handle.net/20.500.12110/paper_01661280_v401_n1-2_p77_Sosa
institution Universidad de Buenos Aires
institution_str I-28
repository_str R-134
collection Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA)
topic Hydrogen bonding
Topological analysis
spellingShingle Hydrogen bonding
Topological analysis
Sosa, G.L.
Peruchena, N.
Contreras, R.H.
Castro, E.A.
Topological analysis of hydrogen bonding interactions involving C-H...O bonds
topic_facet Hydrogen bonding
Topological analysis
description A topological analysis of two model systems in which different C-H⋯O hydrogen bonds exist is performed in order to characterize them. It is found that it is necessary to analyze the topological properties of the acceptor atom involved in the hydrogen bond since several parameters are qualitatively different in both complexes. This behaviour seems to suggest a way of identifying these bonds. © 1997 Elsevier Science B.V.
format JOUR
author Sosa, G.L.
Peruchena, N.
Contreras, R.H.
Castro, E.A.
author_facet Sosa, G.L.
Peruchena, N.
Contreras, R.H.
Castro, E.A.
author_sort Sosa, G.L.
title Topological analysis of hydrogen bonding interactions involving C-H...O bonds
title_short Topological analysis of hydrogen bonding interactions involving C-H...O bonds
title_full Topological analysis of hydrogen bonding interactions involving C-H...O bonds
title_fullStr Topological analysis of hydrogen bonding interactions involving C-H...O bonds
title_full_unstemmed Topological analysis of hydrogen bonding interactions involving C-H...O bonds
title_sort topological analysis of hydrogen bonding interactions involving c-h...o bonds
url http://hdl.handle.net/20.500.12110/paper_01661280_v401_n1-2_p77_Sosa
work_keys_str_mv AT sosagl topologicalanalysisofhydrogenbondinginteractionsinvolvingchobonds
AT peruchenan topologicalanalysisofhydrogenbondinginteractionsinvolvingchobonds
AT contrerasrh topologicalanalysisofhydrogenbondinginteractionsinvolvingchobonds
AT castroea topologicalanalysisofhydrogenbondinginteractionsinvolvingchobonds
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