We present results of a quantum-mechanical calculation of electron current density, magnetic susceptibility and proton magnetic shielding in the cyclopropenyl cation, reflecting on the ring-current model. The current density induced in and out of the molecular plane by a perpendicular magnetic field is plotted, showing the existence of localized distributions and paramagnetic circulations around the centre of the molecule.

Inconsistency of the Ring Current Model for the Cyclopropenyl Cation / Lazzeretti, Paolo; R., Zanasi. - In: CHEMICAL PHYSICS LETTERS. - ISSN 0009-2614. - STAMPA. - 80:(1981), pp. 533-536.

Inconsistency of the Ring Current Model for the Cyclopropenyl Cation

LAZZERETTI, Paolo;
1981

Abstract

We present results of a quantum-mechanical calculation of electron current density, magnetic susceptibility and proton magnetic shielding in the cyclopropenyl cation, reflecting on the ring-current model. The current density induced in and out of the molecular plane by a perpendicular magnetic field is plotted, showing the existence of localized distributions and paramagnetic circulations around the centre of the molecule.
80
533
536
Inconsistency of the Ring Current Model for the Cyclopropenyl Cation / Lazzeretti, Paolo; R., Zanasi. - In: CHEMICAL PHYSICS LETTERS. - ISSN 0009-2614. - STAMPA. - 80:(1981), pp. 533-536.
Lazzeretti, Paolo; R., Zanasi
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/11380/454492
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