Relative electrophilicity and aromaticity

Chemical Physics Letters

Volumn 484, Issue 4-6, 2010, Pages 363-367

  Noorizadeh, Siamak ^a   Shakerzadeh, Ehsan ^a  

^a SHAHID CHAMRAN UNIVERSITY OF AHVAZ   (Iran)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATE MODEL; AROMATICITIES; ELECTROPHILICITY; FULVENE; HETEROCYCLIC RINGS; LINEAR CORRELATION; QUADRATIC MODELS; STABILIZATION ENERGY;

ELECTRON TRANSITIONS; ISOMERS;

ISOMERIZATION;

EID: 72649086872     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2009.11.035     Document Type: Article

References (69)

1. Schleyer P.v.R., and Jiao H. Pure Appl. Chem. 68 (1996) 209
2. Wakita K., Tokitoh N., Okazaki R., Nagase S., Schleyer P.v.R., and Jiao H. J. Am. Chem. Soc. 121 (1999) 11336
3. Schleyer P.v.R., and Fuhlhofer F. Org. Lett. 4 (2002) 2873
4. De Proft F., and Geerlings P. Phys. Chem. Chem. Phys. 6 (2004) 242
5. De Proft F., Schleyer P.v.R., Stahl F., Van Lenthe J.H., and Geerlings P. Chem. Eur. J. 8 (2002) 3402
6. Havenith R.W.A., et al. J. Am. Chem. Soc. 124 (2002) 2363
7. Wannere C.S., and Schleyer P.v.R. Org. Lett. 5 (2002) 865
8. Schleyer P.v.R., Maerker C., Dransfeld A., and Jiao H. J. Am. Chem. Soc. 118 (1996) 6317
9. Poater J., Solà M., Viglione R.G., and Zanasi R. J. Org. Chem. 69 (2004) 7537
10. Faglioni F., et al. Org. Lett. 7 (2005) 3457
11. Aihara J.I., and Sumio O. Bull. Chem. Soc. Jpn. 76 (2003) 1363
12. Aihara J.I. Bull. Chem. Soc. Jpn. 77 (2004) 101
13. Lazzeretti P. Phys. Chem. Chem. Phys. 6 (2004) 217
14. Gomes J.A.N.F., and Mallion R.B. Chem. Rev. 101 (2001) 1349
15. Krygowski T.M., and Cyrànski M.K. Phys. Chem. Chem. Phys. 6 (2004) 249
16. Chen Z., Wannere C.S., Corminboeuf C., Puchta R., and Schleyer P.v.R. Chem. Rev. 105 (2005) 3842
17. Parr R.G., and Yang W. Density Functional Theory of Atoms and Molecules (1989), Oxford University Press, New York
18. Parr R.G., and Pearson R.G. J. Am. Chem. Soc. 105 (1983) 7512
19. Parr R.G., Donnelly R.A., Levy M., and Palke W.E. J. Chem. Phys. 68 (1978) 3801
20. Politzer P., and Murry J.S. Chem. Phys. Lett. 431 (2006) 195
21. March N.H. J. Chem. Phys. 76 (1982) 1869
22. Fuentealba P., and Parr R.G. J. Chem. Phys. 94 (1991) 5559
23. Janak J.F. Phys. Rev. B 18 (1978) 7165
24. Zhou Z., Parr R.G., and Garst J.F. Tetrahedron Lett. 29 (1989) 4843
25. Roy R.K., Choho K., De Proft F., and Geerlings P. J. Phys. Org. Chem. 12 (1999) 503
26. Balawender R., Komorowski L., De Proft F., and Geerlings P. J. Phys. Chem. A 102 (1998) 9912
27. Chamizo J.A., Morgado J., and Sosa O. Organometallics 12 (1993) 5005
28. De Proft F., and Geerlings P. Chem. Rev. 101 (2001) 1451
29. Parr R.G., Szentpaly L.V., and Liu S. J. Am. Chem. Soc. 121 (1999) 1922
30. Makedonas C., and Mitsopoulou C.A. Eur. J. Inorg. Chem. 26 (2007) 4176
31. De Vleeschouwer F., Van Speybroeck V., Waroquier M., Geerlings P., and De Proft F. Org. Lett. 9 (2007) 2721
32. Padmanabhan J., Parthasarathi R., Subramanian V., and Chattaraj P.K. J. Phys. Chem. A 111 (2007) 1358
33. Roy D.R., Parthasarathi R., Padmanabhan J., Sarkar U., Subramanian V., and Chattaraj P.K. J. Phys. Chem. A 110 (2006) 1084
34. Moraleda D., El Abed D., Pollissier H., and Santelli M. J. Mol. Struct. (THEOCHEM) 760 (2006) 113
35. Campodonico P.R., Aizman A., and Contreras R. Chem. Phys. Lett. 422 (2006) 340
36. Sarkar U., Padmanabhan J., Parthasarathi R., Subramanian V., and Chattaraj P.K. J. Mol. Struct. (THEOCHEM) 758 (2006) 119
37. Moncada J.L., and Toro-Labbe A. Chem. Phys. Lett. 429 (2006) 161
38. Padmanabhan J., Parthasarathi R., Subramanian V., and Chattaraj P.K. J. Mol. Struct. (THEOCHEM) 730 (2005) 221
39. Glossman-Mitnik D. J. Mol. Struct. (THEOCHEM) 725 (2005) 27
40. Olah J., De Proft F., Veszpremi T., and Geerlings P. J. Phys. Chem. A 109 (2005) 1608
41. Chattaraj P.K., and Roy D.R. J. Phys. Chem. A 109 (2005) 3771
42. Elango M., Parthasarathi R., Subramanian V., Sarkar U., and Chattaraj P.K. J. Mol. Struct. (THEOCHEM) 723 (2005) 43
43. Roy R.K. J. Phys. Chem. A 108 (2004) 4934
44. Chamorro E., Chattaraj P.K., and Fuentealba P. J. Phys. Chem. A 107 (2003) 7068
45. Cadet J., Grand A., Morell C., Letelier J.R., Moncada J.L., and Toro-Labbe A. J. Phys. Chem. A 107 (2003) 5334
46. Pérez P., Aizman A., and Contreras R. J. Phys. Chem. A 106 (2002) 3964
47. Chattaraj P.K., Pérez P., Zevallos J., and Toro-Labbe A. J. Phys. Chem. A 105 (2001) 4272
48. Chattaraj P.K., Sarkar U., and Roy D.R. Chem. Rev. 106 (2006) 2065
49. Chattaraj P.K., and Giri S. Annu. Rep. Prog. Chem. - Sect. C 105 (2009) 13
50. Parthasarathi R., Elango M., Subramanian V., and Chattaraj P.K. Theor. Chem. Acc. 113 (2005) 257
51. Noorizadeh S., and Maihami H. J. Mol. Struct. (THEOCHEM) 763 (2006) 133
52. Noorizadeh S. J. Phys. Org. Chem. 20 (2007) 514
53. Noorizadeh S. Chin. J. Chem. 10 (2008) 1439
54. Noorizadeh S., and Shakerzadeh E. J. Mol. Struct. (THEOCHEM) 888 (2008) 22
55. Torrent-Sucarrat M., Liu S., and De proft F. J. Phys. Chem. A 113 (2009) 3698
56. Xia Y., Yin D., Rong C., Xu Q., Yin D., and Liu S. J. Phys. Chem. A 112 (2008) 9970
57. Chaquin P. Chem. Phys. Lett. 458 (2008) 231
58. Noorizadeh S., and Shakerzadeh E. J. Phys. Chem. A 112 (2008) 3486
59. Noorizadeh S., and Shakerzadeh E. J. Mol. Struct. 920 (2009) 110
60. M.J. Frisch et al., Gaussian 98, Revision A.7, Gaussian, Inc., Pittsburgh, PA, 1998.
61. Del Re G. In aromaticity, pseudo-aromaticity, anti-aromaticity. In: Bergmann E.D., and Pullman B. (Eds). Proceedings of the Jerusalem International Symposium (1971), The Israel Academy of Sciences and Humanities, Jerusalem 74
62. Cioslowski J., Matito E., and Solà M. J. Phys. Chem. A 111 (2007) 6521
63. Mandado M., González-Moa M.J., and Mosquera R.A. J. Comput. Chem. 28 (2007) 127
64. Schleyer P.v.R., Freeman P.K., Jiao H., and Goldfuss B. Angew. Chem., Int. Ed. Engl. 34 (1995) 337
65. Novak I. J. Mol. Struct. (THEOCHEM) 399 (1997) 315
66. Friedman P., and Ferris K.F. Int. J. Quant. Chem. Symp. 24 (1990) 843
67. Bird C.W. Tetrahedron 48 (1992) 335
68. Havenith R.W.A., Fowler P.W., and Steiner E. J. Chem. Soc., Perkin Trans. 2 (2002) 502
69. Domingo L.R., Sáez J.A., and Pérez P. Chem. Phys. Lett. 438 (2007) 341