The conventional interpretation of proton NMR chemical shifts is supported by large basis set ab initio quantum mechanical calculations. The benzene protons are predicted to lie within the deshielding zone defined in terms of the out-of-plane magnetic shielding domain. However, ring currents by themselves are not sufficient to account quantitatively for the observed benzene proton downfield chemical shift. or-Electron contributions must also be taken into account. The conventional explanation for the ethyne proton chemical shift is valid
Direct evaluation of the induced π current density in [5]paracyclophane (1) shows that, despite the ...
The local response to an external magnetic field normal to the molecular plane of naphthalene and an...
Direct evaluation of the induced pi current density in [5]paracyclophane (1) shows that, despite the...
The conventional interpretation of proton NMR chemical shifts is supported by large basis set ab ini...
The conventional interpretation of proton NMR chemical shifts is supported by large basis set ab ini...
According to the ring current model quoted in textbooks of nuclear magnetic resonance spectroscopy, ...
Plots of proton magnetic shielding density in the benzene molecule, obtained via accurate coupled Ha...
Traces of magnetizability, traces of magnetic shielding at the hydrogen nuclei, and nucleus-independ...
Coupled Hartree–Fock perturbation theory is employed to evaluate the magnetic susceptibility, proton...
Symmetry arguments show that the ring-current model proposed by Pauling, Lonsdale, andLondon to expl...
Symmetry arguments show that the ring-current model proposed by Pauling, Lonsdale, and London to exp...
The pattern of the electron currents, induced in the benzene molecule by uniform magnetic fields, ha...
Based on the nucleus-independent chemical shift (NICS) concept, isotropic magnetic shielding values ...
The differential Biot-Savart law of classical electrodynamics was applied to develop a ring current ...
Direct evaluation of the induced π current density in [5]paracyclophane (1) shows that, despite the ...
The local response to an external magnetic field normal to the molecular plane of naphthalene and an...
Direct evaluation of the induced pi current density in [5]paracyclophane (1) shows that, despite the...
The conventional interpretation of proton NMR chemical shifts is supported by large basis set ab ini...
The conventional interpretation of proton NMR chemical shifts is supported by large basis set ab ini...
According to the ring current model quoted in textbooks of nuclear magnetic resonance spectroscopy, ...
Plots of proton magnetic shielding density in the benzene molecule, obtained via accurate coupled Ha...
Traces of magnetizability, traces of magnetic shielding at the hydrogen nuclei, and nucleus-independ...
Coupled Hartree–Fock perturbation theory is employed to evaluate the magnetic susceptibility, proton...
Symmetry arguments show that the ring-current model proposed by Pauling, Lonsdale, andLondon to expl...
Symmetry arguments show that the ring-current model proposed by Pauling, Lonsdale, and London to exp...
The pattern of the electron currents, induced in the benzene molecule by uniform magnetic fields, ha...
Based on the nucleus-independent chemical shift (NICS) concept, isotropic magnetic shielding values ...
The differential Biot-Savart law of classical electrodynamics was applied to develop a ring current ...
Direct evaluation of the induced π current density in [5]paracyclophane (1) shows that, despite the ...
The local response to an external magnetic field normal to the molecular plane of naphthalene and an...
Direct evaluation of the induced pi current density in [5]paracyclophane (1) shows that, despite the...