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Ferraro, M.B.; Faglioni, F.; Ligabue, A.; Pelloni, S.; Lazzeretti, P. "Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule" (2005) Magnetic Resonance in Chemistry. 43(4):316-320
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Abstract:

The differential Biot-Savart law of classical electrodynamics was applied to develop a ring current model for the magnetic shielding of the carbon nucleus in benzene. It is shown that the local effect of the π currents, induced by a magnetic field normal to the molecular plane, on the σC out-of-plane shielding tensor component vanishes. However, approximately 10% of σC is due to the shielding contributions from π current density in the region of the other carbon atoms. Magnetic shielding density maps obtained via quantum mechanical procedures confirm the predictions of the classical model. Copyright © 2004 John Wiley & Sons, Ltd.

Registro:

Documento: Artículo
Título:Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule
Autor:Ferraro, M.B.; Faglioni, F.; Ligabue, A.; Pelloni, S.; Lazzeretti, P.
Filiación:Departamento de Física, Facultad de Ciencias Exactas Y Naturales, Ciudad Universitaria, Pab. I, (1428) Buenos Aires, Argentina
Dipartimento di Chimica, Università degli Studi di Modena e Reggio Emilia, Via Campi 183, 41100 Modena, Italy
Palabras clave:Benzene; Carbon; Differential Biot-Savart law; Magnetic shielding; NMR; Ring current; benzene; carbon; article; atom; density; electric current; magnetism; molecular model; quantum mechanics; chemistry; mathematics; methodology; nuclear magnetic resonance spectroscopy; quantum theory; Benzene; Carbon; Magnetic Resonance Spectroscopy; Mathematics; Quantum Theory
Año:2005
Volumen:43
Número:4
Página de inicio:316
Página de fin:320
DOI: http://dx.doi.org/10.1002/mrc.1536
Título revista:Magnetic Resonance in Chemistry
Título revista abreviado:Magn. Reson. Chem.
ISSN:07491581
CODEN:MRCHE
CAS:benzene, 71-43-2; carbon, 7440-44-0; Benzene, 71-43-2; Carbon, 7440-44-0
Registro:https://bibliotecadigital.exactas.uba.ar/collection/paper/document/paper_07491581_v43_n4_p316_Ferraro

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Citas:

---------- APA ----------
Ferraro, M.B., Faglioni, F., Ligabue, A., Pelloni, S. & Lazzeretti, P. (2005) . Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule. Magnetic Resonance in Chemistry, 43(4), 316-320.
http://dx.doi.org/10.1002/mrc.1536
---------- CHICAGO ----------
Ferraro, M.B., Faglioni, F., Ligabue, A., Pelloni, S., Lazzeretti, P. "Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule" . Magnetic Resonance in Chemistry 43, no. 4 (2005) : 316-320.
http://dx.doi.org/10.1002/mrc.1536
---------- MLA ----------
Ferraro, M.B., Faglioni, F., Ligabue, A., Pelloni, S., Lazzeretti, P. "Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule" . Magnetic Resonance in Chemistry, vol. 43, no. 4, 2005, pp. 316-320.
http://dx.doi.org/10.1002/mrc.1536
---------- VANCOUVER ----------
Ferraro, M.B., Faglioni, F., Ligabue, A., Pelloni, S., Lazzeretti, P. Ring current effects on nuclear magnetic shielding of carbon in the benzene molecule. Magn. Reson. Chem. 2005;43(4):316-320.
http://dx.doi.org/10.1002/mrc.1536