Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants

Fil:Peralta, J.E. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina.

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Detalles Bibliográficos
Autores principales:	Peralta, Juan Ernesto, Ruiz de Azúa, Martín César, Contreras, Rubén Horacio
Publicado:	1999
Materias:	Bond orbitals Oxygen atoms Shielding constants carbon hydrogen oxygen water article chemical binding chemical interaction complex formation energy geometry hydrogen bond nuclear magnetic resonance quantum chemistry
Acceso en línea:	https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01661280_v491_n1-3_p23_Peralta http://hdl.handle.net/20.500.12110/paper_01661280_v491_n1-3_p23_Peralta
Aporte de:	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA) de Universidad de Buenos Aires

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spelling	paper:paper_01661280_v491_n1-3_p23_Peralta2023-06-08T15:15:19Z Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants Peralta, Juan Ernesto Ruiz de Azúa, Martín César Contreras, Rubén Horacio Bond orbitals Oxygen atoms Shielding constants carbon hydrogen oxygen water article chemical binding chemical interaction complex formation energy geometry hydrogen bond nuclear magnetic resonance quantum chemistry Fil:Peralta, J.E. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. Fil:Ruiz De Azúa, M.C. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. Fil:Contreras, R.H. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina. 1999 https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01661280_v491_n1-3_p23_Peralta http://hdl.handle.net/20.500.12110/paper_01661280_v491_n1-3_p23_Peralta
institution	Universidad de Buenos Aires
institution_str	I-28
repository_str	R-134
collection	Biblioteca Digital - Facultad de Ciencias Exactas y Naturales (UBA)
topic	Bond orbitals Oxygen atoms Shielding constants carbon hydrogen oxygen water article chemical binding chemical interaction complex formation energy geometry hydrogen bond nuclear magnetic resonance quantum chemistry
spellingShingle	Bond orbitals Oxygen atoms Shielding constants carbon hydrogen oxygen water article chemical binding chemical interaction complex formation energy geometry hydrogen bond nuclear magnetic resonance quantum chemistry Peralta, Juan Ernesto Ruiz de Azúa, Martín César Contreras, Rubén Horacio Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
topic_facet	Bond orbitals Oxygen atoms Shielding constants carbon hydrogen oxygen water article chemical binding chemical interaction complex formation energy geometry hydrogen bond nuclear magnetic resonance quantum chemistry
description	Fil:Peralta, J.E. Universidad de Buenos Aires. Facultad de Ciencias Exactas y Naturales; Argentina.
author	Peralta, Juan Ernesto Ruiz de Azúa, Martín César Contreras, Rubén Horacio
author_facet	Peralta, Juan Ernesto Ruiz de Azúa, Martín César Contreras, Rubén Horacio
author_sort	Peralta, Juan Ernesto
title	Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
title_short	Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
title_full	Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
title_fullStr	Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
title_full_unstemmed	Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants
title_sort	natural bond orbitals analysis of c-h ··· o interactions in nch/h2o and nch/och2, and their effect on nuclear magnetic shielding constants
publishDate	1999
url	https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01661280_v491_n1-3_p23_Peralta http://hdl.handle.net/20.500.12110/paper_01661280_v491_n1-3_p23_Peralta
work_keys_str_mv	AT peraltajuanernesto naturalbondorbitalsanalysisofchointeractionsinnchh2oandnchoch2andtheireffectonnuclearmagneticshieldingconstants AT ruizdeazuamartincesar naturalbondorbitalsanalysisofchointeractionsinnchh2oandnchoch2andtheireffectonnuclearmagneticshieldingconstants AT contrerasrubenhoracio naturalbondorbitalsanalysisofchointeractionsinnchh2oandnchoch2andtheireffectonnuclearmagneticshieldingconstants
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Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants

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