Photoelectron spectroscopic study of the negative ions of 4-thiouracil and 2,4-dithiouracil

Journal of Chemical Physics

Volumn 134, Issue 7, 2011, Pages

  Li, Xiang ^a   Chen, Jing ^a   Bowen, Kit H ^a  

^a JOHNS HOPKINS UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

5-FLUOROURACIL; BROAD BANDS; PHOTOELECTRON SPECTRUM; SPECTROSCOPIC STUDIES; VERTICAL DETACHMENT ENERGIES;

ELECTRONIC STRUCTURE; PHOTOELECTRON SPECTROSCOPY; PHOTONS; SPECTROSCOPIC ANALYSIS; SULFUR;

NEGATIVE IONS;

2,4-DITHIOURACIL; 4 THIOURACIL; 4-THIOURACIL; DITHIOURACIL; DRUG DERIVATIVE; THIOURACIL;

ARTICLE; CHEMISTRY; X RAY PHOTOELECTRON SPECTROSCOPY;

PHOTOELECTRON SPECTROSCOPY; THIOURACIL;

EID: 79951913304     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3555177     Document Type: Article

References (62)

1. M. N. Lipsett, J. Biol. Chem. 240, 3975 (1965).
2. W. Saenger, Principle of Nucleic Acid Structures (Springer-Verlag, New York, 1984).
3. H. Charbonneau, N. Beier, K. A. Walsh, and J. A. Beavo, Proc. Natl. Acad. Sci. U.S.A. 83, 9308 (1986). 10.1073/pnas.83.24.9308
4. R. Osman, S. Topiol, L. Rubenstein, and H. Weinstein, Mol. Pharmacol. 32, 699 (1987).
5. M. J. Nowak, L. Lapinski, and J. S. Kwiatkowski, in Computational Chemistry: Reviews of Current Trends, edited by, J. Leszczynski, (World Scientific, Singapore, 1997), Vol. 2, p. 140.
6. S. D. Wetmore, R. J. Boyd, and L. A. Eriksson, Chem. Phys. Lett. 343, 151 (2001). 10.1016/S0009-2614(01)00652-2 (Pubitemid 33630819)
7. P. Civcir, J. Phys. Org. Chem. 14, 171 (2001) 10.1002/poc.349 (Pubitemid 33658995)
8. S. Denifl, S. Matejcik, B. Gstir, G. Hanel, M. Probst, P. Scheier, and T. D. Mrka, J. Chem. Phys 118, 4107 (2003). 10.1063/1.1540108
9. V. Esposito, A. Randazzo, G. Piccialli, L. Petraccone, C. Giancola, and L. Mayol, Org. Biomol. Chem. 2, 313 (2004). 10.1039/b314672c
10. H. J. Pownall, A. M. Schaffer, R. S. Becker, and W. M. Mantulin, Photochem. Photobiol. 27, 625 (1978). 10.1111/j.1751-1097.1978.tb07655.x
11. L. Lapinski, M. J. Nowak, R. Kolos, J. S. Kwiatkowski, and J. Leszczynski, Spectrochim. Acta, Part A 54, 685 (1998). 10.1016/S1386-1425(97) 00278-3
12. M. Inazumi, F. Kano, and S. Sakata, Chem. Pharm. Bull. (Tokyo) 40, 2147 (1992).
13. Z. Wang and T. M. Rana, Biochemistry 35, 6491 (1996). 10.1021/bi960037p (Pubitemid 26164082)
14. U. Mars and B. S. Larsoon, Pigment Cell Res. 8, 194 (1995). 10.1111/j.1600-0749.1995.tb00663.x
15. S. Zamenhof, R. DeGiovanni, and S. Greer, Nature (London) 181, 827 (1958). 10.1038/181827a0
16. W. C. Deway, B. A. Sedita, and R. M. Humphrey, Science 152, 519 (1966). 10.1126/science.152.3721.519
17. F. Hutchinson, Q. Rev. Biophys. 6, 201 (1973). 10.1017/S0033583500001141
18. T. S. Lawrence, M. A. Davis, J. Maybaum, P. L. Stetson, and W. D. Ensminger, Radiat. Res. 123, 192 (1990). 10.2307/3577544 (Pubitemid 20262299)
19. H. Sugiyama, Y. Tsutsumi, and I. Saito, J. Am. Chem. Soc. 112, 6720 (1990). 10.1021/ja00174a046
20. T. Chen, G. P. Cook, A. T. Koppisch, and M. M. Greenberg, J. Am. Chem. Soc. 122, 3861 (2000). 10.1021/ja994357i (Pubitemid 30241588)
21. A. Le and L. Adamowicz, J. Am. Chem. Soc. 112, 1504 (1990). 10.1021/ja00160a032
22. H. Rostkowska, K. Szczepaniak, M. J. Nowak, J. Leszczynski, K. KuBulat, and W. B. Person, J. Am. Chem. Soc. 112, 2147 (1990). 10.1021/ja00162a016
23. J. Leszczynski and K. Lammertsma, J. Phys. Chem. 95, 3128 (1991). 10.1021/j100161a032
24. J. Leszczynski and J. poner, J. Mol. Struct. 388, 237 (1996).
25. L. Lapinski, H. Rostkowska, M. J. Nowak, J. S. Kwiatkowski, and J. Leszczynski, Vib. Spectrosc. 13, 23 (1996). 10.1016/0924-2031(96)00026-4 (Pubitemid 126393553)
26. M. J. Wjcik, M. Boczar, M. Wieczorek, and W. Tatara, J. Mol. Struct. 555, 165 (2000). 10.1016/S0022-2860(00)00598-6 (Pubitemid 32064917)
27. T. Marino, N. Russo, E. Sicilia, and M. Toscano, Int. J. Quantum Chem. 82, 44 (2001). 10.1002/1097-461X(2001)82:144::AID-QUA10203.0.CO;2-6
28. A. M. Lamsabhi, M. Alcam, O. M, and M. Ynez, ChemPhysChem 4, 1011 (2003). 10.1002/cphc.200300704
29. M. K. Shukla and J. Leszczynski, J. Phys. Chem. A 108, 7241 (2004). 10.1021/jp049358y
30. F. Meng, J. Mol. Struct.: THEOCHEM 806, 159 (2007). 10.1016/j.theochem. 2006.11.023
31. G. N. Ten, T. G. Burova, and V. I. Baranov, J. Struct. Chem. 48, 447 (2007). 10.1007/s10947-007-0067-z
32. Y. V. Rubin, Y. Morozov, D. Venkateswarlu, and J. Leszczynski, J. Phys. Chem. A 102, 2194 (1998). 10.1021/jp9726798
33. M. Lamsabhi, M. Alcam, O. M, W. Bouab, M. Esseffar, J. L.-M. Abboud, and M. Yanez, J. Phys. Chem. A 104, 5122 (2000). 10.1021/jp000071k
34. A. Psoda, Z. Kazimierczuk, and D. Shugar, J. Am. Chem. Soc. 96, 6832 (1974). 10.1021/ja00829a003
35. N. Igarashi-Yamamoto, A. Tajiri, M. Hatano, S. Shibuya, and T. Ueda, Biochim. Biophys. Acta 656, 1 (1981). 10.1016/0005-2787(81)90020-4
36. M. Graindourze, T. Grootaers, J. Smets, Th. Zeegers-Huyskens, and G. Maes, J. Mol. Struct. 237, 389 (1990). 10.1016/0022-2860(90)80154-C
37. M. Graindourze, T. Grootaers, J. Smets, Th. Zeegers-Huyskens, and G. Maes, J. Mol. Struct. 243, 37 (1991). 10.1016/0022-2860(91)87025-D
38. G. Maes, M. Graindourze, and J. Smets, J. Mol. Struct. 248, 89 (1991). 10.1016/0022-2860(91)85005-N
39. Y. V. Rubin, F. A. Savin, and Y. P. Blagoi, Stud. Biophys. 123, 205 (1988).
40. J. Peeling, F. E. Hruska, D. M. Mc Kinnon, M. S. Chauhan, and N. S. McIntyre, Can. J. Chem. 56, 2405 (1978). 10.1139/v78-393
41. Z. B. Maksic, K. Rupnik, and A. Veseli, J. Electron Spectrosc. Relat. Phenom. 32, 163 (1983). 10.1016/0368-2048(83)85094-4
42. K. Szczepaniak, A. Barski, H. Baranska, and D. Shugar, in C. R. International Conference on Raman Spectroscopy, 7th ed., edited by, W. F. Murphy, (North-Holland, Amsterdam, 1980), p. 590.
43. M. Ghomi, R. Ltellier, E. Taillandier, L. Chinsky, A. Laigle, and P. Y. Turpin, J. Raman Spectrosc. 17, 249 (1986). 10.1002/jrs.1250170304
44. Handbook of Proton-NMR Spectra and Data, Asahi Research Center Co., Ltd. (Academic, New York, 1985).
45. E. Shefter and H. G. Mautner, J. Am. Chem. Soc. 89, 1249 (1967). 10.1021/ja00981a035
46. M. Gerhards, O. C. Thomas, J. M. Nilles, W.-J. Zheng, and K. H. Bowen, J. Chem. Phys. 116, 10247 (2002). 10.1063/1.1477924 (Pubitemid 34711732)
47. B. Boudaiffa, P. Cloutier, D. Hunting, M. A. Huels, and L. Sanche, Science 287, 1658 (2000). 10.1126/science.287.5458.1658 (Pubitemid 30127768)
48. F. Martin, P. D. Burrow, Z. Cai, P. Cloutier, D. Hunting, and L. Sanche, Phys. Rev. Lett. 93, 0681011 (2004). 10.1103/PhysRevLett.93.068101
49. L. Sanche, Mass Spectrom. Rev. 21, 349 (2002). 10.1002/mas.10034
50. C. Desfranois, V. Periquet, Y. Bouteiller, and J. P. Schermann, J. Phys. Chem. A 102, 1274 (1998). 10.1021/jp9728417
51. M. D. Sevilla, B. Besler, and A. O. Colson, J. Phys. Chem. 99, 1060 (1995). 10.1021/j100003a032
52. N. A. Richardson, S. S. Wesolowski, and H. F. Schaefer III, J. Phys. Chem. B 107, 848 (2003). 10.1021/jp022111l
53. O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz, Chem. Phys. Lett. 307, 220 (1999). 10.1016/S0009-2614(99)00492-3
54. R. A. Bachorz, W. Klopper, and M. Gutowski, J. Chem. Phys. 126, 085101 (2007). 10.1063/1.2436890 (Pubitemid 46355632)
55. R. A. Bachorz, W. Klopper, M. Gutowski, X. Li, and K. H. Bowen, J. Chem. Phys. 129, 054309 (2008). 10.1063/1.2965128
56. N. A. Oyler and L. Adamowicz, J. Phys. Chem. 97, 11122 (1993). 10.1021/j100144a037
57. J. H. Hendricks, S. A. Lyapustina, H. L. de Clercq, J. T. Snodgrass, and K. H. Bowen, J. Chem. Phys. 104, 7788 (1996). 10.1063/1.471482
58. C. Desfrancois, H. Abdoul-Carime, and J. P. Schermann, Int. J. Mod. Phys. B 10, 1339 (1996). 10.1142/S0217979296000520
59. X. Li, K. H. Bowen, M. Haranczyk, R. A. Bachorz, K. Mazurkiewicz, J. Rak, and M. Gutowski, J. Chem. Phys. 127, 174309 (2007). 10.1063/1.2795719 (Pubitemid 350075527)
60. K. Aflatooni, G. A. Gallup, and P. D. Burrow, J. Phys. Chem. A 102, 6205 (1998). 10.1021/jp980865n
61. O. Dolgounitcheva, V. G. Zakrzewski, and J. V. Ortiz, J. Chem. Phys. 134, 074305 (2011). 10.1063/1.3555179
62. D. Radisic, Y. J. Ko, J. M. Niles, S. T. Stokes, M. D. Sevilla, J. Rak, and K. H. Bowen, J. Chem. Phys. 134, 015101 (2011). 10.1063/1.3525623