Artículo
Peralta, J.E.; Ruiz De Azúa, M.C.; Contreras, R.H. "Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants" (1999) Journal of Molecular Structure: THEOCHEM. 491(1-3):23-31
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| Documento: | Artículo |
| Título: | Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants |
| Autor: | Peralta, J.E.; Ruiz De Azúa, M.C.; Contreras, R.H. |
| Filiación: | Departamento de Física, Fac. de Ciencias Exactas y Naturales, Ciudad Universitaria, Pabellón 1, 1428 Buenos Aires, Argentina |
| Palabras clave: | 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 |
| Año: | 1999 |
| Volumen: | 491 |
| Número: | 1-3 |
| Página de inicio: | 23 |
| Página de fin: | 31 |
| DOI: | http://dx.doi.org/10.1016/S0166-1280(99)00027-5 |
| Título revista: | Journal of Molecular Structure: THEOCHEM |
| Título revista abreviado: | J. Mol. Struct. THEOCHEM |
| ISSN: | 01661280 |
| CODEN: | THEOD |
| CAS: | carbon, 7440-44-0; hydrogen, 12385-13-6, 1333-74-0; oxygen, 7782-44-7; water, 7732-18-5 |
| Registro: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_01661280_v491_n1-3_p23_Peralta |
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Citas:
---------- APA ----------
Peralta, J.E., Ruiz De Azúa, M.C. & Contreras, R.H. (1999) . Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants. Journal of Molecular Structure: THEOCHEM, 491(1-3), 23-31.http://dx.doi.org/10.1016/S0166-1280(99)00027-5
---------- CHICAGO ----------
Peralta, J.E., Ruiz De Azúa, M.C., Contreras, R.H. "Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants" . Journal of Molecular Structure: THEOCHEM 491, no. 1-3 (1999) : 23-31.http://dx.doi.org/10.1016/S0166-1280(99)00027-5
---------- MLA ----------
Peralta, J.E., Ruiz De Azúa, M.C., Contreras, R.H. "Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants" . Journal of Molecular Structure: THEOCHEM, vol. 491, no. 1-3, 1999, pp. 23-31.http://dx.doi.org/10.1016/S0166-1280(99)00027-5
---------- VANCOUVER ----------
Peralta, J.E., Ruiz De Azúa, M.C., Contreras, R.H. Natural bond orbitals analysis of C-H ··· O interactions in NCH/H2O and NCH/OCH2, and their effect on nuclear magnetic shielding constants. J. Mol. Struct. THEOCHEM. 1999;491(1-3):23-31.http://dx.doi.org/10.1016/S0166-1280(99)00027-5
