Excited states of bridged [14]annulenes

Journal of Physical Chemistry A

Volumn 108, Issue 40, 2004, Pages 8279-8286

  Moroni, Laura ^a   Gellini, Cristina ^a   Salvi, Pier Remigio ^a   Vogel, Emanuel ^b  

^a UNIVERSITY OF FLORENCE   (Italy)

^b UNIVERSITY OF COLOGNE   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; FLUORESCENCE; MOLECULAR VIBRATIONS; OLEFINS; PROBABILITY DENSITY FUNCTION; RAMAN SCATTERING; RAMAN SPECTROSCOPY;

ANNULENES; EXCITED STATES; FLUORESCENCE SPECTRA; RAMAN EXCITATION;

ELECTRON ENERGY LEVELS;

EID: 6344237629     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0474780     Document Type: Article

References (47)

1. Klessinger, M.; Michl, J. Excited states and photochemistry of organic molecules; VCH Publishers: New York, 1994.
2. Siebrand, W. M.; Zgierski, M. Z. In, Excited states; Lim, E. C., Ed.; Academic Press: New York, 1979; Vol. 4, pp 1-135.
3. Craig.-D. P. J. Chem. Soc., London 1950, 2146-2151.
4. Ziegler, L. D.; Hudson, B. S. In Excited states; Lim, E. C., Ed.; Academic Press: New York, 1982; Vol. 5, pP 42-140.
5. Innes, K. K. In Excited states; Lim, E. C., Ed.; Academic Press: New York, 1975; Vol. 2, pp 1-32.
6. Swiderek, P.; Hohlneicher, G.; Maluendes, S. A.; Dupuis, M. J. Chem. Phys. 1993, 98, 974-987.
7. Zerbetto, F.; Zgierski, M. Z. Chem. Phys. 1988, 127, 17-29.
8. Kolc, J.; Michl, J.; Vogel, E. J. Am. Chem. Soc. 1976, 98, 3935-3948.
9. Dewey, H. J.; Deger, H.; Frolich, W.; Dick, B.; Klingensmith, K. A.; Hohlneicher, G.; Vogel, E.; Michl, J. J. Am. Chem. Soc. 1980, 102, 6412-6417.
10. Klingensmith, K. A.; Dewey, H. J.; Vogel, E.; Michl, J. J. Am. Chem. Soc. 1989, 111, 1539-1546.
11. Catani, L.; Gellini, C.; Salvi, P. R. J. Phys. Chem. A 1998, 102, 1945-1953.
12. Catani, L.; Gellini, C.; Moroni, L.; Salvi, P. R. J. Phys. Chem. A 2000, 104, 6566-6572.
13. Seiler, R.; Kensy, U.; Dick, B. Phys. Chem. Chem. Phys. 2001, 3, 5373-5382.
14. Giugni, A.; Eramo, R.; Cavalieri, S.; Pietraperzia, G.; Becucci, M.; Gellini, C.; Moroni, L.; Salvi, P. R. Chem. Phys. Lett. 200, 330, 315-324.
15. Moroni, L.; Gellini,.C.; Salvi, P. R.; Liu, C.-J.; Vogel, E. J. Phys. Chem. A 2002, 106, 6554-6562.
16. Hay, P. J.; Shavitt, I. J. Chem. Phys. 1974, 60, 2865-2877.
17. Matos, J. M.; Roos, B. O.; Malmqvist, P.-A. J. Chem. Phys. 1987, 86, 1458-1466.
18. Kato, S. J. Chem. Phys. 1988, 88, 3045-3056.
19. Palmer, M. H.; Walker, I. C. Chem. Phys. 1989, 133, 113-121.
20. Orlandi, G.; Palmieri, P.; Tarroni, R.; Zerbetto, F.; Zgierski, M. Z. J. Chem. Phys. 1994, 100, 2458-2464.
21. S. Zilberg, Y. H.; Shaik, S. J. Phys. Chem. 1995, 99, 16558-16565.
22. Vogel, E.; Reel, H. J. Am. Chem. Soc. 1972, 94, 4388-4389.
23. Vogel, E.; Vogel, A.; Kübbeler, H. K.; Sturm, W. Angew. Chem., Int. Ed. 1970, 9, 514-516.
24. Dupuis, M.; Spangler, D.; Wendoloski, J. J. NRCC Software Catalog, vol.1, program n. QG01, GAMESS; 1980.
25. Bianchi, R.; Casalone, G.; Simonetta, M. Acta Crystallogr. B 1975, 31, 1207-1209.
26. Gavezzotti, A.; Mugnoli, A.; Raimondi, M.; Simonetta, M. J. Chem. Soc., Perkin II 1972, pages 425-431.
27. Nendel, M.; Houk, K. N.; Tolbert, L. M.; Vogel, E.; Jiao, H.; v. R. Schleyer, P. J. Phys. Chem. A 1998, 102, 7191-7198.
28. Nendel, M.; Houk, K. N.; Tolbert, L. M.; Vogel, E.; Jiao, H.; v. R. Schleyer, P. Angew. Chem., Int. Ed. Engl. 1997, 36, 748-750.
29. Julg, A.; Francois, P. Theor. Chim. Acta 1967, 8, 249-259.
30. Deẇ, M. J. S.; Dougherty, R. C. PMO Theory in Organic Chemistry; Plenum: New York, 1975.
31. Moffitt, W. J. Chem. Phys. 1954, 22, 320-333.
32. Coulson, C.; Rushbrooke, G. Proc. Cambridge Philos. Soc. 1940, 36, 193-200.
33. Pariser, R. J. Chem. Phys. 1956, 26, 250-268.
34. Nakano, H. J. Chem. Phys. 1993, 99, 7983-7992.
35. Nakano, H.; Yamanishi, M.; Hirao, K. Trends Chem. Phys. 1997, 6, 167-214.
36. Albrecht, A. C. J. Chem. Phys. 1961, 34, 1476-1484.
37. Albrecht, A. C.; Hutley, M. C. J. Chem. Phys. 1971, 55, 4438-4443.
38. Tang, J.; Albrecht, A. C. In Raman Spectroscopy. Theory and Practice; Szymansky, H. A., Ed.; Plenum: New York, 1970.
39. Clark, R. J. H.; Dines, T. J. Angew. Chem., Int. Ed. Engl. 1986, 25, 131-158.
40. Bonang, C. C.; Cameron, S. M. J. Chem. Phys. 1992, 97, 5377-5383.
41. Ohta, N.; Ito, M. Chem. Phys. 1977, 20, 71-81.
42. Gallagher, S. H.; Armstrong, R.; Clucas, W. A.; Lay, P. A.; Reed, C. A. J. Phys. Chem. A 1997, 101, 2960-2968.
43. Bree, A. Chem. Phys. Lett. 1986, 131, 65-69.
44. Manneback, C. Physica 1951, 17, 1001-1010.
45. Clark, R. J. H.; Dines, T. J. Mol. Phys. 1981, 42, 193-207.
46. Siebrand, W.; Zgierski, M. Z. J. Phys. Chem. 1982, 86, 4718-4725.
47. Ziegler, L. D.; Hudson, B. J. Chem. Phys. 1981, 74, 982-992.