Registro:
Documento: |
Artículo
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Título: | Through-bond and through-space JFF spin-spin coupling in peridifluoronaphthalenes: Accurate DFT evaluation of the four contributions |
Autor: | Peralta, J.E.; Barone, V.; Contreras, R.H.; Zaccari, D.G.; Snyder, J.P. |
Filiación: | Departamento de Física, FCEyN, Universidad de Buenos Aires, Buenos Aires, Argentina
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Palabras clave: | naphthalene derivative; chemical binding; chemical structure; geometry; letter; rotation; Fluorine; Hydrocarbons, Fluorinated; Magnetic Resonance Spectroscopy; Naphthalenes |
Año: | 2001
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Volumen: | 123
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Número: | 37
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Página de inicio: | 9162
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Página de fin: | 9163
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DOI: |
http://dx.doi.org/10.1021/ja011164y |
Título revista: | Journal of the American Chemical Society
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Título revista abreviado: | J. Am. Chem. Soc.
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ISSN: | 00027863
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CODEN: | JACSA
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CAS: | Fluorine, 7782-41-4; Hydrocarbons, Fluorinated; Naphthalenes
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Registro: | https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_00027863_v123_n37_p9162_Peralta |
Referencias:
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- note; Frisch, M.J., Trucks, G.W., Schlegel, H.B., Scuseria, G.E., Robb, M.A., Cheeseman, J.R., Zakrzewski, V.G., Pople, J.A., (1998) Gaussian 98, Revision A.7, , Gaussian, Inc.: Pittsburgh, PA
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- Peralta, J.E., Barone, V., Ruiz de Azúa, M.C., Contreras, R.H., (2001) Mol. Phys., 99, pp. 655-661
- Barone, V., Peralta, J.E., Contreras, R.H., Sosnin, A.V., Krivdin, L.B., Magn. Reson. Chem., , In press
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- Peralta, J.E., Contreras, R.H., Snyder, J.P., (2000) Chem. Commun., pp. 2025-2026
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Citas:
---------- APA ----------
Peralta, J.E., Barone, V., Contreras, R.H., Zaccari, D.G. & Snyder, J.P.
(2001)
. Through-bond and through-space JFF spin-spin coupling in peridifluoronaphthalenes: Accurate DFT evaluation of the four contributions. Journal of the American Chemical Society, 123(37), 9162-9163.
http://dx.doi.org/10.1021/ja011164y---------- CHICAGO ----------
Peralta, J.E., Barone, V., Contreras, R.H., Zaccari, D.G., Snyder, J.P.
"Through-bond and through-space JFF spin-spin coupling in peridifluoronaphthalenes: Accurate DFT evaluation of the four contributions"
. Journal of the American Chemical Society 123, no. 37
(2001) : 9162-9163.
http://dx.doi.org/10.1021/ja011164y---------- MLA ----------
Peralta, J.E., Barone, V., Contreras, R.H., Zaccari, D.G., Snyder, J.P.
"Through-bond and through-space JFF spin-spin coupling in peridifluoronaphthalenes: Accurate DFT evaluation of the four contributions"
. Journal of the American Chemical Society, vol. 123, no. 37, 2001, pp. 9162-9163.
http://dx.doi.org/10.1021/ja011164y---------- VANCOUVER ----------
Peralta, J.E., Barone, V., Contreras, R.H., Zaccari, D.G., Snyder, J.P. Through-bond and through-space JFF spin-spin coupling in peridifluoronaphthalenes: Accurate DFT evaluation of the four contributions. J. Am. Chem. Soc. 2001;123(37):9162-9163.
http://dx.doi.org/10.1021/ja011164y