Infrared absorption of gaseous benzoylperoxy radical C 6H 5C(O)OO recorded with a step-scan Fourier-transform spectrometer

Journal of Chemical Physics

Volumn 135, Issue 22, 2011, Pages

  Golec, Barbara ^a   Chen, Jin Dah ^a   Lee, Yuan Pern ^a,b  

^a NATIONAL CHIAO TUNG UNIVERSITY   (Taiwan)

^b INSTITUTE OF ATOMIC AND MOLECULAR SCIENCES   (Taiwan)

Author keywords

[No Author keywords available]

Indexed keywords

ABSORPTION CELLS; ACETOPHENONES; BENZOYL RADICALS; FOURIER TRANSFORM SPECTROMETERS; INFRARED INTENSITY; INTENSE BANDS; MULTI-PASS; ROTATIONAL PARAMETERS; TRANSIENT SPECIES; VIBRATIONAL WAVE NUMBERS;

ALDEHYDES; DEFORMATION; FOURIER TRANSFORM INFRARED SPECTROSCOPY; KETONES; PHOTOLYSIS; SPECTROMETRY;

SPECTROMETERS;

EID: 83755206849     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3664304     Document Type: Article

References (50)

1. N. S. Allen, M. C. Marin, M. Edge, D. W. Davies, J. Garret, F. Jones, S. Navaratnam, and B. J. Parsons, J. Photochem. Photobiol A: Chem. 126, 135 (1999). 10.1016/S1010-6030(99)00110-0
2. J. G. Calvert, R. Atkinson, K. H. Becker, R. M. Kamens, J. H. Seinfeld, T. J. Wallington, and G. Yarwood, The Mechanisms of Atmospheric Oxidation of Aromatic Hydrocarbons (Oxford University Press, London, 2002).
3. R. Atkinson, Atmos. Environ. 34, 2063 (2000). 10.1016/S1352-2310(99) 00460-4 (Pubitemid 30151067)
4. C. E. McDade, T. M. Lenhardt, and K. D. Bayers, J. Photochem. 20, 1 (1982). 10.1016/0047-2670(82)80042-7
5. F. Kirchner, F. Zabel, and K. H. Becker, Chem. Phys. Lett. 191, 169 (1992). 10.1016/0009-2614(92)85387-P
6. J. M. Heuss and W. A. Glasson, Environ. Sci. Technol. 2, 1109 (1968). 10.1021/es60023a003
7. R. Atkinson and A. C. Lloyd, J. Phys Chem. Ref. Data 13, 315 (1984). 10.1063/1.555710
8. C. E. Brown, A. G. Neville, D. M. Rayner, K. U. Ingold, and J. Lusztyk, Aust. J. Chem. 48, 363 (1995). 10.1071/CH9950363
9. W. Knolle, U. Müller, and R. Mehnert, Phys. Chem. Chem. Phys. 2, 1425 (2000). 10.1039/a907162h
10. M. Hoshino, R. Konishi, H. Seto, H. Seki, H. Sonoki, T. Yokoyama, and H. Shimamori, Res. Chem. Intermed. 27, 189 (2001). 10.1163/156856701745078 (Pubitemid 32406841)
11. T. Hancock-Chen and J. C. Scaiano, Photochem. Photobiol. 67, 174 (1998). 10.1111/j.1751-1097.1998.tb05183.x
12. G. E. Zaikov, J. A. Howard, and K. U. Ingold, Can. J. Chem. 47, 3017 (1969). 10.1139/v69-500
13. F. Caralp, V. Foucher, R. Lesclaux, T. J. Wallington, and M. D. Hurley, Phys. Chem. Chem. Phys. 1, 3509 (1999). 10.1039/a903088c
14. C. Kolano, G. Bucher, H. H. Wenk, M. Jäger, O. Schade, and W. Sander, J. Phys. Org. Chem. 17, 207 (2004). 10.1002/poc.715
15. E. Roth, A. Chakir, and A. Ferhati, J. Phys. Chem. A 114, 10367 (2010). 10.1021/jp1021467
16. A. G. Neville, C. E. Brown, D. M. Rayner, J. Lusztyk, and K. U. Ingold, J. Am. Chem. Soc. 113, 1869 (1991). 10.1021/ja00005a082
17. A. G. Merzlikine, S. V. Voskresensky, E. O. Danilov, D. C. Neckers, and A. V. Fedorov, Photochem. Photobiol. Sci. 6, 608 (2007). 10.1039/b614792e (Pubitemid 46889465)
18. A. Mardyukov and W. Sander, Eur. J. Org. Chem. 15, 2904 (2010). 10.1002/ejoc.201000153
19. S.-H. Chen, L.-K. Chu, Y.-J. Chen, I.-C. Chen, and Y.-P. Lee, Chem. Phys. Lett. 333, 365 (2001). 10.1016/S0009-2614(00)01372-5 (Pubitemid 33642261)
20. L.-K. Chu, Y.-P. Lee, and E. Y. Jiang, J. Chem. Phys. 120, 3179 (2004). 10.1063/1.1641007
21. S.-Y. Chen and Y.-P. Lee, J. Chem. Phys. 132, 114303 (2010). 10.1063/1.3352315
22. L.-K. Chu and Y.-P. Lee, J. Chem. Phys. 133, 184303 (2010). 10.1063/1.3495765
23. J.-D. Chen and Y.-P. Lee, J. Chem. Phys. 134, 094304 (2011). 10.1063/1.3556817
24. W. Uhmann, A. Becker, C. Taran, and F. Siebert, Appl. Spectrosc. 45, 390 (1991). 10.1366/0003702914337128
25. L. B. Clark and I. Tinoco Jr., J. Am. Chem. Soc. 87, 11 (1965). 10.1021/ja01079a003
26. Y. Chen and L. Zhu, J. Phys. Chem. A, 107, 4643 (2003). 10.1021/jp022440d
27. M. J. Frisch, G. W. Trucks, and H. B Schlegel, GAUSSIAN 09, REVISION A.2, Gaussian, Inc., Pittsburgh, PA, 2009.
28. A. D. Becke, J. Chem. Phys. 98, 5648 (1993). 10.1063/1.464913
29. C. Lee, W. Yang, and R. G. Parr, Phys. Rev. B 37, 785 (1988). 10.1103/PhysRevB.37.785
30. T. H. Dunning, Jr., J. Chem. Phys. 90, 1007 (1989). 10.1063/1.456153
31. D. E. Woon and T. H. Dunning Jr., J. Chem. Phys. 98, 1358 (1993). 10.1063/1.464303
32. H.-Q. Zhao, Y.-S. Cheung, C.-L. Liao, C.-X. Liao, C. Y. Ng, and W.-K. Li, J. Chem. Phys. 107, 7230 (1997). 10.1063/1.474964
33. B. Nozire, R. Lesclaux, M. D. Hurley, M. A. Dearth, and T. J. Wallington, J. Phys. Chem. 98, 2864 (1994). 10.1021/j100062a023
34. NIST Mass Spec. Data Center, S. E. Stein, director, Infrared spectra in NIST Chemistry WebBook, NIST Standard Reference Database Number 69; Edited by, P. J. Linstrom, and, W. G. Mallard, (National Institute of Standards and Technology, Gaithersburg, MD, March 2003), 20899, see http://webbook.nist.gov.
35. A. Gambi, S. Giorgianni, A. Passerini, R. Visinoni, and S. Ghersetti, Spectrochim. Acta 36A, 871 (1980). 10.1016/0584-8539(80)80036-5
36. P. Palmer, B. Zuckerman, D. Buhl, and L. E. Snyder, Astrophys. J. 156, L147 (1969). 10.1086/180368
37. S. G. Stepanian, I. D. Reva, E. D. Radchenko, and G. G. Sheina, Vib. Spectrosc. 11, 123 (1996). 10.1016/0924-2031(95)00068-2 (Pubitemid 126403306)
38. M. Haurie and A. Novak, J. Chim. Phys. Phys.-Chim. Biol. 62, 137 (1965).
39. 5C(O)OO with the B3LYPcc-pVDZ method.
40. R. X. Fernandes, K. Luther, and J. Troe, J. Phys. Chem. A 110, 4442 (2006). 10.1021/jp056850o (Pubitemid 43672205)
41. T. Ohta and I. Mizoguchi, Environ. Sci. Technol. 15, 1229 (1981). 10.1021/es00092a013
42. T. Yu and M. C. Lin, J. Am. Chem. Soc. 116, 9571 (1994). 10.1021/ja00100a022
43. S. C. Foster, P. Misra, T.-Y. D. Lin, C. P. Damo, C. C. Carter, and T. A. Miller, J. Phys. Chem. 92, 5914 (1988). 10.1021/j100332a014
44. Y.-Y. Lee, G.-H. Wann, and Y.-P. Lee, J. Chem. Phys. 99, 9465 (1993). 10.1063/1.465481
45. J.-X. Han, Y. G. Utkin, H.-B. Chen, L. A. Burns, and R. F. Curl, J. Chem. Phys. 117, 6538 (2002). 10.1063/1.1507116 (Pubitemid 35327207)
46. T. M. Ramond, G. E. Davico, R. L. Schwartz, and W. C. Lineberger, J. Chem. Phys. 112, 1158 (2000). 10.1063/1.480767
47. A. Mardyukov and W. Sander, Chem. Eur. J. 15, 1462 (2009). 10.1002/chem.200801546
48. C. Reichardt, J. Schroeder, P. Vöhringer, and D. Schwarzer, Phys. Chem. Chem. Phys. 10, 1662 (2008). 10.1039/b718501d
49. J. Pacansky and D. W. Brown, J. Phys. Chem. 87, 1553 (1983). 10.1021/j100232a020
50. V. Stakhursky and T. A. Miller, in 56th OSU International Symposium on Molecular Spectroscopy, Columbus, OH, 2001; SPECVIEW: Simulation and Fitting of Rotational Structure of Electronic and Vibronic Bands, http://www.chemistry. ohio-state.edu/-vstakhur.