Vibrational spectra and theoretical calculations of p-chlorophenol in the electronically excited S1 and ionic ground D0 states

Journal of Photochemistry and Photobiology A: Chemistry

Volumn 193, Issue 2-3, 2008, Pages 245-253

  Huang, Jianhan ^a,c   Huang, Kelong ^a   Liu, Suqin ^a   Luo, Qiong ^a   Tzeng, Wenbih ^b  

^a CENTRAL SOUTH UNIVERSITY   (China)

^b INSTITUTE OF ATOMIC AND MOLECULAR SCIENCES   (Taiwan)

^c INSTITUTE OF CHEMISTRY   (China)

Author keywords

1C R2PI; 2C R2PI; Band origin; IE; Isotope effect; MATI

Indexed keywords

EID: 36348959558     PISSN: 10106030     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jphotochem.2007.07.002     Document Type: Article

References (40)

1. Stafford U., Gray K.A., Kamat P.V., and Varma A. Chem. Phys. Lett. 205 (1993) 55
2. Nakagawa S., Matsushita Y., Suzuki T., and Ichimura T. J. Mol. Struct. 779 (2005) 68
3. Yamamoto S., Ebata T., and Ito M. J. Phys. Chem. 93 (1989) 6340
4. Oikawa A., Abe H., Mikami N., and Ito M. J. Phys. Chem. 88 (1984) 5180
5. Cockett M.C.R., Takahashi M., Okuyama K., and Kimura K. Chem. Phys. Lett. 187 (1991) 250
6. Böhm M., Ratzer C., and Schmitt M. J. Mol. Struct. 800 (2006) 55
7. Zierkiewicz W., Michalska D., and Thére'se Z.H. J. Phys. Chem. A 104 (2000) 11685
8. Ahn D.S., Park S.W., Lee S.Y., and Kim B.S. J. Phys. Chem. A 107 (2003) 131
9. Han J., Deming R.L., and Tao F.M. J. Phys. Chem. A 108 (2004) 7736
10. Imhof P., Gler D.K., Brause R., and Kleinermanns K. J. Chem. Phys. 121 (2004) 2598
11. Garrigou-Lagrange C., Lebas J.M., and Josien M.L. Spectrochim. Acta. A 12 (1958) 305
12. Imhof P., and Kleinermanns K. Phys. Chem. Chem. Phys. 4 (2002) 264
13. Huang J., Lin J.L., and Tzeng W.B. Chem. Phys. Lett. 422 (2006) 271
14. Philis J.G. Spectrochim. Acta A 61 (2005) 1239
15. Huang Y., and Sulkes M. Chem. Phys. Lett. 254 (1996) 242
16. Hirano A., Tsumanuma H., Kishi K., and Egawa T. J. Mol. Struct. 701 (2004) 9
17. Philis J.G. J. Mol. Spectrosc. 232 (2005) 26
18. Egawa T., Yamada T., and Konaka S. Chem. Phys. Lett. 324 (2000) 260
19. Philis J.G., Drougas E., and Kosmas A.M. Chem. Phys. 306 (2004) 253
20. Bellert D., and Breckenridge W.H. Chem. Phys. Lett. 337 (2001) 103
21. Wu C., He Y., and Kong W. Chem. Phys. Lett. 398 (2004) 351
22. Müller-Dethlefs K., Sander M., and Schlag E.W. Chem. Phys. Lett. 112 (1984) 291
23. Zhu L., and Johnson P.M. J. Chem. Phys. 94 (1991) 5769
24. Tzeng W.B., and Lin J.L. J. Phys. Chem. A 103 (1999) 8612
25. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, J.A. Pople, GAUSSIAN 03, Revision B.05, Gaussian, Inc., Pittsburgh, PA, 2003.
26. Lin J.L., and Tzeng W.B. J. Chem. Phys. 115 (2001) 743
27. Lin J.L., Li C., and Tzeng W.B. J. Chem. Phys. 120 (2004) 10513
28. Lembach G., and Brutschy B. Chem. Phys. Lett. 273 (1997) 421
29. Lin J.L., and Tzeng W.B. J. Chem. Phys. 113 (2000) 4109
30. Varsanyi G. Assignments for Vibrational Spectra of Seven Hundred Benzene Derivatives (1974), New York Academic Press, New York and London pp. 161-184
31. Dopfer O., and Müller-Dethlefs K. J. Chem. Phys. 101 (1994) 8508
32. Li C., Lin J.L., and Tzeng W.B. J. Chem. Phys. 122 (2005) 044311
33. Gerhards M., Unterberg C., and Schumm S. J. Chem. Phys. 111 (1999) 7966
34. Fujimaki E., Fujii A., Ebata T., and Maikami N. J. Chem. Phys. 110 (1999) 4238
35. Unterberg C., Gerlach A., Jansen A., and Gerhards M. Chem. Phys. 304 (2004) 237
36. Zhang B., Li C., Su H.W., Lin J.L., and Tzeng W.B. Chem. Phys. Lett. 390 (2004) 65
37. Li C., Pradhan M., and Tzeng W.B. Chem. Phys. Lett. 411 (2005) 506
38. Drougas E., Philis J.G., and Kosmas A.M. J. Mol. Struct. (Theochem) 758 (2006) 17
39. Mineyama M., and Egawa T. J. Mol. Struct. 734 (2005) 61
40. Bist H.D., Brand J.C.D., and William D.R. J. Mol. Spectrosc. 24 (1967) 42