MU Chemistry 416 FS97

Literature List on Shielding I
Local Contributions



NMR Shielding and the Periodic Table. Gerothanassis, I. P.; Kalodimos, C. G. J. Chem. Educ. 1996, 73, 801-804.
A useful discussion of trends of diamagnetic and paramagnetic shielding across the periodic table. This article offers a lot in terms of quantifying ranges and magnitudes. A must study!

Coupled-cluster calculations of nuclear magnetic resonance chemical shifts. Gauss, J.; Stanton, J. F. J. Chem. Phys. 1995, 103(9), 3561-3577.
Do not worry about the theory in this paper. Go right for the good stuff, the numbers in the tables toward the end.

Benzenediazonium Ion. Generality, Consistency, and Preferability of the Electron Density Based Dative Bonding Model. Glaser, R.; Horan, C. J. J. Org. Chem. 1995, 60, 7518-7528.
Contains a useful discussion that stresses that chemical shifts in 13C- and 14,15N-NMR have nothing to do with atomic charge.

Electron excitation effects on NMR shieldings in small organic molecules. Augspurger, J. D.; Dykstra, C. E. Chem. Phys. Lett. 1995, 238, 199-202.
This article gives you some information about the kinds of organic molecules that will give large electron excitation effects.

An Improved Experiment to Illustrate the Effect of Electronegativity on Chemical Shift. Boggess, R. K. J. Chem. Educ. 1988, 65, 819-820.
Electronegativity effects on H-NMR as discussed in lecture.