A TD-DFT study on triplet excited-state properties of curcumin and its implications in elucidating the photosensitizing mechanisms of the pigment

Chemical Physics Letters

Volumn 409, Issue 4-6, 2005, Pages 300-303

  Shen, Liang ^a   Ji, Hong Fang ^a   Zhang, Hong Yu ^a  

^a SHANDONG UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; ELECTRIC EXCITATION; ENERGY TRANSFER; OXYGEN; PHOTOSENSITIVITY; PIGMENTS; PROBABILITY DENSITY FUNCTION; REACTION KINETICS; TOXIC MATERIALS;

CURCUMIN; EXCITED-STATE PROPERTIES; PHOTODYNAMIC MECHANISM; TIME-DEPENDENT DENSITY FUNCTIONAL THEORY (TD-DFT);

AROMATIC COMPOUNDS;

EID: 84962349316     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2005.05.023     Document Type: Article

References (30)

1. O.P. Sharma Biochem. Pharmacol. 25 1976 1811
2. B. Vijayalaxmi Mutat. Res. 79 1980 125
3. B. Mishra, K.I. Priyadarsini, M.K. Bhide, R.M. Kadam, and H. Mohan Free Radical Res. 38 2004 355
4. G. Litwinienko, and K.U. Ingold J. Org. Chem. 69 2004 5888
5. A.J. Ruby, G. Kuttan, and K.D. Babu Cancer Lett. 94 1995 79
6. B.B. Aggarwal, A. Kumar, and A.C. Bharti Anticancer Res. 23 2003 363
7. M.E. Egan, M. Pearson, S.A. Weiner, V. Rajendran, D. Rubin, J. Gloökner-Pagel, S. Canny, K. Du, G.L. Lukacs, and M.J. Caplan Science 304 2004 600
8. E.S. Jankun, N.P. McCabe, S.H. Selman, and J. Jankun Int. J. Mol. Med. 6 2000 521
9. N. Sreejayan, K.I. Priyadarsini, T.P.A. Devasagayam, and M.N.A. Rao Int. J. Pharm. 151 1997 125
10. T.A. Dahl, P. Bilski, K.J. Reszka, and C.F. Chignell Photochem. Photobiol. 59 1994 290
11. C.F. Chignell, P. Bilski, K.J. Reszka, A.N. Motten, R.H. Sik, and T.A. Dahl Photochem. Photobiol. 59 1994 295
12. T.A. Dahl, W.M. McGowan, M.A. Shand, and V.S. Srinivasan Arch. Microbiol. 151 1989 183
13. A.A. Gorman, V.S. Hamblett, V.S. Srinivasan, and P.D. Wood Photochem. Photobiol. 59 1994 389
14. Y.-M. Sun, H.-Y. Zhang, D.-Z. Chen, and C.-B. Liu Org. Lett. 4 2002 2909
15. J.S. Wright J Mol. Struct. - Theochem. 591 2002 207
16. L. Shen, H.-Y. Zhang, and H.-F. Ji Org. Lett. 7 2005 243
17. R. Bauernschmitt, and R. Ahlrichs Chem. Phys. Lett. 256 1996 454
18. F. Furche J. Chem. Phys. 114 2001 5982
19. M. Parac, and S. Grimme J. Phys. Chem. A 106 2002 6844
20. M.J.S. Dewar, E.G. Zoebisch, E.F. Healy, and J.J.P. Stewart J. Am. Chem. Soc. 107 1985 3902
21. R.E. Stratmann, G.E. Scuseria, and M.J. Frisch J. Chem. Phys. 109 1998 8218
22. J. Llano, J. Raber, and L.A. Eriksson J. Photochem. Photobiol. A 154 2003 235
23. S. Miertus, E. Scrocco, and J. Tomasi Chem. Phys. 55 1981 117
24. S. Miertus, and J. Tomasi Chem. Phys. 65 1982 239
25. M. Cossi, V. Barone, and J. Cammi Chem. Phys. Lett. 255 1996 327
26. M.J. Frisch Gaussian 03 2003 Gaussian, Inc. Pittsburgh, PA
27. L.R.C. Barclay, M.R. Vinqvist, K. Mukai, Y. Hashimoto, A. Tokunaga, and H. Uno Org. Lett. 2 2000 2841
28. K.P. Huber, G. Herzberg, Molecular Spectra and Molecular Structure. Part IV. New York, 1979
29. HJH. Fenton J. Chem. Soc. 65 1894 889
30. F. Haber, and J. Weiss Proc. Roy. Soc. Lond. Ser. A 147 1934 332