XeNO3+: A gaseous cation characterized by a remarkably strong Xe-O bond

Journal of Physical Chemistry A

Volumn 102, Issue 29, 1998, Pages 5831-5836

  Bernardi, Fernando ^a   Cacace, Fulvio ^b   De Petris, Giulia ^b   Pepi, Federico ^b   Rossi, Ivan ^a  

^a UNIVERSITY OF BOLOGNA   (Italy)

^b SAPIENZA UNIVERSITY OF ROME   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001496829     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp980781e     Document Type: Article

References (43)

1. Bartlett, N. Proc. Chem. Soc. (London) 1962, 218.
2. Edwards, A. J.; Holloway, J. H.; Peacock, R. D. Proc. Chem. Soc. 1963, 275.
3. Cohen, B.; Peacock, R. D. J. Inorg. Nuclear Chem. 1966, 28, 3056; McRae, V. M.; Peacock, R. D.; Russel, D. R. Chem. Commun. 1969, 62.
4. Cohen, B.; Peacock, R. D. J. Inorg. Nuclear Chem. 1966, 28, 3056; McRae, V. M.; Peacock, R. D.; Russel, D. R. Chem. Commun. 1969, 62.
5. Sladky, F. O.; Bulliner, P. A.; Bartlett, N.; DeBoer, B. G.; Zalkin, A. Chem. Commun. 1968, 1048. Binenboym, J.; Selig, H.; Shamir, J. J. Inorg. Nucl. Chem. 1968, 30, 2863.
6. Sladky, F. O.; Bulliner, P. A.; Bartlett, N.; DeBoer, B. G.; Zalkin, A. Chem. Commun. 1968, 1048. Binenboym, J.; Selig, H.; Shamir, J. J. Inorg. Nucl. Chem. 1968, 30, 2863.
7. Holloway, J. H.; Knowles, J. G. J. Chem. Soc. (A) 1969, 756. Bartlett, N.; Gennis, M.; Gilber, D. D.; Morrel, B. K.; Zalkin, A. Inorg. Chem. 1973, 12, 1717.
8. Holloway, J. H.; Knowles, J. G. J. Chem. Soc. (A) 1969, 756. Bartlett, N.; Gennis, M.; Gilber, D. D.; Morrel, B. K.; Zalkin, A. Inorg. Chem. 1973, 12, 1717.
9. LeBlond, R. D.; DesMarteau, D. D. J. Chem. Soc. Chem., Commun. 1974, 555. Sawyer, J. F.; Schrobilgen, G. J.; Sutherland, S. J. Inorg. Chem. 1982, 21, 4064.
10. LeBlond, R. D.; DesMarteau, D. D. J. Chem. Soc. Chem., Commun. 1974, 555. Sawyer, J. F.; Schrobilgen, G. J.; Sutherland, S. J. Inorg. Chem. 1982, 21, 4064.
11. Emara, A. A. A.; Schrobilgen, G. J. J. Chem. Soc., Chem. Commun. 1987, 1644. Schrobilgen, G. J. J. Chem. Soc., Chem. Commun. 1988, 1506.
12. Emara, A. A. A.; Schrobilgen, G. J. J. Chem. Soc., Chem. Commun. 1987, 1644. Schrobilgen, G. J. J. Chem. Soc., Chem. Commun. 1988, 1506.
13. Emara, A. A. A.; Schrobilgen, G. J. J. Chem. Soc., Chem. Commun. 1988, 257.
14. Emara, A. A. A.; Schrobilgen, G. J. Inorg. Chem. 1992, 31, 1323.
15. Frohn, H. J.; Jakobs, S. J. Chem. Soc., Chem. Commun. 1989, 625.
16. Zhdankin, V. V.; Stang, P. J.; Zefirov, N. S. J. Chem. Soc., Chem. Commun. 1992, 578. Frohn, H. J.; Klose, A.; Henkel, G. Angew. Chem., Int. Ed. Engl. 1993, 32, 99.
17. Zhdankin, V. V.; Stang, P. J.; Zefirov, N. S. J. Chem. Soc., Chem. Commun. 1992, 578. Frohn, H. J.; Klose, A.; Henkel, G. Angew. Chem., Int. Ed. Engl. 1993, 32, 99.
18. Bartlett, N.; Wechsberg, M.; Sladky, F.; Bulliner, P. A.; Jones, G. R.; Burbank, R.D. Chem. Commun. 1969, 703. Sladky, F. Angew. Chem. 1969, 87, 536. McKee, D. E.; Adams, C. J.; Bartlett, N. Inorg. Chem. 1973, 12, 1722.
19. Bartlett, N.; Wechsberg, M.; Sladky, F.; Bulliner, P. A.; Jones, G. R.; Burbank, R.D. Chem. Commun. 1969, 703. Sladky, F. Angew. Chem. 1969, 87, 536. McKee, D. E.; Adams, C. J.; Bartlett, N. Inorg. Chem. 1973, 12, 1722.
20. Bartlett, N.; Wechsberg, M.; Sladky, F.; Bulliner, P. A.; Jones, G. R.; Burbank, R.D. Chem. Commun. 1969, 703. Sladky, F. Angew. Chem. 1969, 87, 536. McKee, D. E.; Adams, C. J.; Bartlett, N. Inorg. Chem. 1973, 12, 1722.
21. Olah, G. A.; Chambers, R. D.; Prakash, G. K. S. In Synthetic Fluorine Chemistry; Wiley: New York, 1992.
22. Davidson, J. A.; Viggiano, A. A.; Howard, C. J.; Dotan, I.; Fehesenfeld, F. C.; Albriton, D. L.; Ferguson, E. E. J. Chem. Phys. 1978, 68, 2085.
23. Cacace, F.; de Petris, G.; Pepi, F.; Angelelli, F. Proc. Natl. Acad. Sci. U.S.A. 1995, 92, 8635.
24. Lias, S. G.; Bartmess, J. E.; Liebman, J. F.; Holmes, J. L.; Levin, R. D.; Mallard, W. G. J. Phys. Chem. Ref. Data 1988, 17, Suppl. 1.
25. Kuo, S.-C.; Zhang, Z.; Ross, S. K.; Klemm, R. B.; Johnson, R. D., III; Monks, P. S.; Peyton Thorn Jr., R.; Stief, L. J. J. Phys. Chem. 1997, 101, 4035.
26. Becke, A. D. Phys. Rev. 1988, 38, 3098.
27. Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. 1988, 37, 785.
28. Godbout, N.; Salahub, D. R.; Andzelm, J.; Wimmer, E. Can. J. Chem. 1992, 70, 560.
29. DZVP Xe basis set was obtained from the Extensible Computational Chemistry Environment Basis Set Database, Version 1.0, as developped and distributed by the Molecular Science Computing Facility, Environmental and Molecular Sciences Laboratory, which is part of the Pacific Northwest Laboratory, P.O. Box 999, Richland, WA 99352. Web address: http:// www.emsl.pnl.gov:2080/forms/basisform.html.
30. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith, T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andrés, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzales, C.; Pople, J. A. Gaussian94, Revision D.3; Gaussian, Inc.: Pittsburgh, PA, 1995.
31. Boys, S. F.; Bernardi, F. Mol. Phys. 1970, 19, 553.
32. For a recent review on the subject see: van Duijneveldt, F. B.; van Duijneveldt, J. G. C. M.;. van Lenthe, J. H Chem. Rev. 1994, 94, 1873.
33. Emsley, J.; Hoyte, O. P. A.; Overill, R. E. J. Am. Chem. Soc. 1978, 100, 3303.
34. Smith, P. H.; Derissen, J. L.; van Duijneveldt, F. B. J. Chem. Phys. 1978, 69, 521.
35. Xantheas, S. S. J. Phys. Chem. 1996, 100, 8821.
36. Pople, J. A.; Head-Gordon, M.; Raghavachari, K. J. Chem. Phys. 1987, 87, 5968.
37. Krishnan, R.; Binkley, J. S.; Seeger, R.; Pople, J. A. J. Chem. Phys. 1980, 72, 650.
38. Wilson, W. W.; Christe, K. O. Inorg. Chem. 1987, 26, 916. Christe, K. O.; Wilson, W. W. Inorg. Chem. 1988, 27, 1296.
39. Wilson, W. W.; Christe, K. O. Inorg. Chem. 1987, 26, 916. Christe, K. O.; Wilson, W. W. Inorg. Chem. 1988, 27, 1296.
40. 2). All other thermochemical values are taken from ref 16.
41. -1 exothermic with respect to the less stable isomer M5.
42. Hiraoka, K.; Yamabe, S. J. Chem. Phys. 1991, 95, 6800.
43. Eisenberg, M.; DesMarteau, D. D. Inorg. Nucl. Chem. Lett. 1970, 6, 29.