Group contribution analysis of xenon NMR solvent shifts

Journal of Physical Chemistry A

Volumn 101, Issue 29, 1997, Pages 5278-5283

  Luhmer, Michel ^a   Bartik, Kristin ^a  

^a UNIVERSITÉ LIBRE DE BRUXELLES   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

COMPOSITION EFFECTS; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; ORGANIC SOLVENTS;

GROUP CONTRIBUTION ANALYSIS;

XENON;

EID: 0031189031     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp970464s     Document Type: Article

References (40)

1. Jameson, C. J. In Multinuclear NMR; Plenum Press: New York, 1987; p 463.
2. Reisse, J. New J. Chem. 1986, 10, 665.
3. Dybowski, C.; Bansal, N. Annu. Rev. Phys. Chem. 1991, 42, 433.
4. Jokisaari, J. Prog. Nucl. Magn. Reson. Spectrosc. 1994, 26, 1.
5. Raftery, D.; Chmelka, B. F. In NMR Basic Principles and Progress. Solid-State NMR I: Methods; Springer-Verlag: Berlin, 1994; Vol. 30, p 111.
6. Raftery, D.; Long, H.; Meersmann, T.; Grandinetti, P. J.; Reven, L.; Pines, A. Phys. Rev. Lett. 1991, 66, 584.
7. Albert, M. S.; Cates, G. D.; Driehuys, B.; Happer, W.; Saam, B.; Springer, C. S.; Wishnia, A. Nature 1994, 370, 199.
8. Albert, M. S.; Tseng, C. H.; Williamson, D.; Oteiza, E. R.; Walsworth, R. L.; Kraft, B.; Kacher, D.; Holman, B. L.; Jolesz, F. A. J. Magn. Reson. Ser. B 1996, 111, 204.
9. Navon, G.; Song, Y. Q.; Room, T.; Appelt, S.; Taylor, R. E.; Pines, A. Science 1996, 271, 1848.
10. Sakai, K.; Bilek, A. M.; Oteiza, E.; Walsworth, R. L.; Balamore, D.; Jolesz, F. A.; Albert, M. S. J. Magn. Reson. Ser. B 1996, 111, 300.
11. Buckingham, A. D.; Schaefer, T.; Schneider, W. G. J. Chem. Phys. 1960, 32, 1227.
12. Kauzmann, W. Quantum Chemistry; Academic Press: New York, 1957.
13. Lau, E. Y.; Gerig, J. T. J. Chem. Phys. 1995, 103, 3341.
14. Onsager, L. J. Am. Chem. Soc. 1936, 58, 1486.
15. Rummens, F. H. A. van der Waals Forces and Shielding Effects; Springer-Verlag: Berlin, 1975; Vol. 10.
16. Rummens, F. H. A. J. Chim. Phys. 1975, 72, 448.
17. Miller, K. W.; Reo, N. V.; Schoot Uiterkamp, A. J. M.; Stengle, D. P.; Stengle, T. R.; Williamson, K. L. Proc. Natl. Acad. Sci. U.S.A. 1981, 78, 4946.
18. Stengle, T. R.; Reo, N. V.; Williamson, K. L. J. Phys. Chem. 1981, 85, 3772.
19. Stengle, T. R.; Hosseini, S. M.; Basiri, H. G.; Williamson, K. L. J. Solut. Chem. 1984, 13, 779.
20. Stengle, T. R.; Hosseini, S. M.; Williamson, K. L. J. Solut. Chem. 1986, 15, 777.
21. Walton, J. H.; Miller, J. B.; Roland, C. M. Appl. Magn. Reson. 1995, 8, 535.
22. Luhmer, M.; Dejaegere, A.; Reisse, J. Magn. Reson. Chem. 1989, 27, 950.
23. Schnitker, J.; Geiger, A. Z. Phys. Chem. N. F. 1987, 155, 29.
24. Luhmer, M.; Van Belle, D.; Reisse, J.; Odelius, M.; Kowalewski, J.; Laaksonen, A. J. Chem. Phys. 1993, 98, 1566.
25. Luhmer, M.; Reisse, J. J. Magn. Reson. Ser. A 1995, 115, 197.
26. Odelius, M.; Laaksonen, A. Mol. Phys. 1994, 82, 487.
27. Luhmer, M.; Moschos, A.; Reisse, J. J. Magn. Reson. Ser. A 1995, 113, 164.
28. Jameson, C. J.; Jameson, A. K.; Baello, B. I.; Lim, H. M. J. Chem. Phys. 1994, 100, 5965.
29. Jameson, C. J.; de Dios, A. C. J. Chem. Phys. 1992, 97, 417.
30. Luhmer, M. Thesis, Université Libre de Bruxelles, 1992.
31. Lim, Y. H.; King, A. D. J. Phys. Chem. 1993, 97, 12173.
32. Lim, Y. H.; Nugara, N.; King, A. D. Appl. Magn. Reson. 1995, 8, 521.
33. Landolt-Börnstein; 6th ed.; Springer-Verlag: Berlin, 1967; Vol. 10.
34. Riddick, J. A.; Bunger, W. B. Organic Solvents: Physical Properties and Methods of Purification, 3rd ed.; Wiley-Interscience: New York, 1970; Vol. II.
35. Gray, C. G.; Gubbins, K. E. Theory of molecular fluids; Clarendon Press: Oxford, 1984; Vol. 1.
36. Wu, H. S.; Sandler, S. I. Ind. Eng. Chem. Res. 1991, 30, 881.
37. Clifford, A. A.; Gray, P.; Platt, N. J. Chem. Soc., Faraday Trans. 1 1977, 73, 381.
38. Jorgensen, W. L.; Madura, J. D.; Swenson, C. J. J. Am. Chem. Soc. 1984, 106, 6638.
39. Luhmer, M.; Dejaegere, A.; Reisse, J. Mol. Phys. 1990, 71, 843.
40. Eliel, E. L.; Allinger, N. L.; Angyal, S. J.; Morrison, G. A. Conformational Analysis; John Wiley & Sons, Inc.: New York, 1965.