Modelling the acidochromism of pyridylazulenes

Chemical Physics Letters

Volumn 457, Issue 1-3, 2008, Pages 91-95

  Jacquemin, Denis ^a   Lewalle, Alexandre ^b   Perpète, Eric A ^a  

^a UNIVERSITY OF NAMUR   (Belgium)

^b KING'S COLLEGE LONDON   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CONFORMATIONS; DICHROISM; DISCRETE FOURIER TRANSFORMS; MOLECULAR STRUCTURE; PH;

ACIDOCHROMISM; AUXOCHROMIC PHENOMENA; PYRIDYLAZULENES;

OPTICAL VARIABLES MEASUREMENT;

EID: 43549125971     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2008.03.084     Document Type: Article

References (20)

1. Wakabayashi S., Kato Y., Mochizuki K., Suzuki R., Matsumoto M., Sugihara Y., and Shimizu M. J. Org. Chem. 72 (2007) 744
2. Liu R.S.H., Muthyala R.S., Wang X.S., Asato A.E., Wang P., and Ye C. Org. Lett. 2 (2000) 269
3. Shevyakov S.V., Li H., Muthyala R., Asato A.E., Croney J.C., Jameson D.M., and Liu R.S.H. J. Phys. Chem. A 107 (2003) 3295
4. Petit L., Adamo C., and Russo N. J. Phys. Chem. B 109 (2005) 12214
5. Jacquemin D., Preat J., Wathelet V., Fontaine M., and Perpète E.A. J. Am. Chem. Soc. 128 (2006) 2072
6. Pezzella A., et al. J. Am. Chem. Soc. 128 (2006) 15490
7. Quartarolo A.D., Russo N., and Sicilia E. Chem. Eur. J. 12 (2006) 6797
8. Improta R., Barone V., and Santoro F. Angew. Chem. Int. Ed. Engl. 46 (2007) 405
9. Ciofini I., and Adamo C. J. Phys. Chem. A 111 (2007) 5549
10. M.J. Frisch et al., Gaussian 03, Revision C.02, 2004, Gaussian, Inc., Wallingford, CT, 2004.
11. Jacquemin D., Wathelet V., and Perpète E.A. J. Phys. Chem. A 110 (2006) 9145
12. Jacquemin D., and Perpète E.A. Chem. Phys. Lett. 429 (2006) 147
13. Jacquemin D., Perpète E.A., Scuseria G.E., Ciofini I., and Adamo C. J. Chem. Theory Comput. 4 (2008) 123
14. Adamo C., and Barone V. J. Chem. Phys. 110 (1999) 6158
15. Ernzerhof M., and Scuseria G.E. J. Chem. Phys. 110 (1999) 5029
16. Tomasi J., Mennucci B., and Cammi R. Chem. Rev. 105 (2005) 2999
17. Cossi M., and Barone V. J. Chem. Phys. 115 (2001) 4708
18. Santoro F., Improta R., Lami A., Bloino J., and Barone V. J. Chem. Phys. 126 (2007) 084509
19. Allen H. Acta Cryst. B 58 (2002) 380
20. Ohta A., Thanh N.C., Terasawa K., Fujimori K., Kuroda S., and Oda M. Tetrahedron Lett. 47 (2006) 2815