Heat of formation of the hydroperoxyl radical HOO via negative ion studies

Journal of Physical Chemistry A

Volumn 106, Issue 42, 2002, Pages 9641-9647

  Ramond, Tanya M ^a,b   Blanksby, Stephen J ^a   Kato, Shuji ^a   Bierbaum, Veronica M ^a   Davico, Gustavo E ^c   Schwartz, Rebecca L ^d   Lineberger, W Carl ^a   Ellison, G Barney ^a  

^a UNIVERSITY OF COLORADO   (United States)

^b NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

^c UNIVERSITY OF IDAHO   (United States)

^d FEDERAL BUREAU OF INVESTIGATION   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; COMBUSTION; ELECTRONS; ENTHALPY; MOLECULES; NEGATIVE IONS; PHOTOELECTRON SPECTROSCOPY; RATE CONSTANTS; SPECIFIC HEAT; THERMAL EFFECTS; THERMODYNAMICS;

BOND ENTHALPIES; HEAT OF FORMATION; HYDROPEROXYL RADICAL; MOLECULAR ELECTRON AFFINITIES; THERMOCHEMICAL CYCLE YIELDS;

FREE RADICALS;

EID: 0037168326     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp014614h     Document Type: Article

References (43)

1. Warnatz, J. Rate Coefficients in the C/H/O System. In Combustion Chemistry; Gardiner, W. C., Jr., Ed.; Springer-Verlag: New York, 1984.
2. Seinfeld, J. H.; Pandis, S. N. Atmospheric Chemistry and Physics: From Air Pollution to Climate Change; Wiley & Sons: New York, 1998.
3. Bohn, B.; Zetzsch, C. J. Phys. Chem. A 1997, 101, 1488.
4. Shum, L. G. S.; Benson, S. W. J. Phys. Chem. A 1983, 87, 3479.
5. Fisher, E. R.; Armentrout, P. B. J. Phys. Chem. A 1990, 94, 4396.
6. Chase, M. W., Jr.; Davies, C. A.; Downey, J. R., Jr.; Frurip, D. J.; McDonald, R. A.; Syverud, A. N. NIST-JANAF Thermochemical Tables, 4th ed.; American Chemical Society: Washington, DC, 1998.
7. Howard, C. J. J. Am. Chem. Soc. 1980, 102, 6937.
8. Hills, A. J.; Howard, C. J. J. Chem. Phys. 1984, 81, 4458.
9. DeMore, W. B.; Sander, S. P.; Golden, D. M.; Hampson, R. F.; Kurylo, M. J.; Howard, C. J.; Ravishankara, A. R.; Kolb, C. E.; Molina, M. J. Chemical Kinetics and Photochemical Data for Use in Stratospheric Modeling: Evaluation Number 12; National Aeronautics and Space Administration, Jet Propulsion Laboratory: Pasadena, CA, 1997.
10. Kegley-Owen, C. S.; Gilles, M. K.; Burkholder, J. B.; Ravishankara, A. R. J. Phys. Chem. A 1999, 103, 5040.
11. Litorja, M.; Ruscic, B. J. Electron Spectrosc. Relat. Phenom. 1998, 97, 131.
12. Thermodynamic Properties of Individual Substances, 4th ed.; Gurvich, L. V.; Veyts, I. V.; Alcock, C. B., Eds.; Hemisphere: New York, 1989; Vol. 1.
13. Carlone, C.; Dalby, F. W. Can. J. Phys. 1969, 47, 1945.
14. -1.
15. Berkowitz, J.; Ellison, G. B.; Gutman, D. J. Phys. Chem. A 1994, 98, 2745.
16. Moylan, C. R.; Brauman, J. I. Annu. Rev. Phys. Chem. 1983, 34, 187.
17. Mordaunt, D. H.; Ashfold, M. N. R. J. Chem. Phys. 1994, 101, 2630.
18. Bierbaum, V. M.; Schmitt, R. J.; DePuy, C. H.; Mead, R. D.; Schulz, P. A.; Lineberger, W. C. J. Am. Chem. Soc. 1981, 103, 6262.
19. Oakes, J. M.; Harding, L. B.; Ellison, G. B. J. Chem. Phys. 1985, 83, 5400.
20. Clifford, E. P.; Wenthold, P. G.; Gareyev, R.; Lineberger, W. C.; DePuy, C. H.; Bierbaum, V. M.; Ellison, G. B. J. Chem. Phys. 1998, 109, 10293.
21. Leopold, D. G.; Murray, K. K.; Miller, A. E. S.; Lineberger, W. C. J. Chem. Phys. 1985, 83, 4849.
22. Ramond, T. M. Negative Ion Photoelectron Spectroscopy of Peroxides, Alkoxides, and Group VIII Transition Metal Oxides. Ph.D. Dissertation, University of Colorado, Boulder, CO, 2001.
23. Cooper, J.; Zare, R. J. Chem. Phys. 1968, 48, 942.
24. Van Doren, J. M.; Barlow, S. E.; DePuy, C. H.; Bierbaum, V. M. Int. J. Mass. Spectrom. Ion Processes 1987, 81, 85.
25. Schalley, C. A.; Schroeder, D.; Schwarz, H.; Moebus, K.; Boche, G. Chem. Ber./Recl. 1997, 130, 1085.
26. Blanksby, S. J.; Kato, S.; Bierbaum, V. M.; Ellison, G. B., to be submitted for publication. 2002.
27. Perin, D. D.; Armarego, W. L. F.; Perrin, D. R. Purification of Laboratory Chemicals, 2nd ed.; Pergamon Press: Oxford, U.K., 1980.
28. Scratchard, G.; Kavanagh, G. M.; Ticknor, L. B. J. Am. Chem. Soc. 1952, 74, 3715.
29. Hunziker, H. E.; Wendt, H. R. J. Chem. Phys. 1974, 60, 4622.
30. Bernath, P. F. Spectra of Atoms and Molecules, 1st ed.; Oxford University Press: New York, 1995.
31. Jacox, M. E.; Milligan, D. E. J. Mol. Spectrosc. 1972, 42, 495.
32. McKellar, A. R. W. J. Chem. Phys. 1979, 71, 81.
33. Smith, D. W.; Andrews, L. J. Chem. Phys. 1974, 60, 81.
34. Blanksby, S. J.; Ramond, T. M.; Davico, G. E.; Nimlos, M. R.; Kato, S.; Bierbaum, V. M.; Lineberger, W. C.; Ellison, G. B.; Okumura, M. J. Am. Chem. Soc. 2001, 123, 9585.
35. Celotta, R. J.; Bennett, R. A.; Hall, J. L.; Siegel, M. W.; Levine, J. Phys. Rev. A 1972, 6, 631.
36. Ervin, K. M.; Gronett, S.; Barlow, S. E.; Gilles, M. K.; Harrison, A. G.; Bierbaum, V. M.; DePuy, C. H.; Lineberger, W. C.; Ellison, G. B. J. Am. Chem. Soc. 1990, 112, 5750.
37. Su, T.; Chesnavich, W. J. J. Chem. Phys. 1982, 76, 5183.
38. Cotton, F. A.; Wilkinson, G.; Murillo, C. A.; Bochmann, M. Advanced Inorganic Chemistry, 6th ed.; Wiley & Sons: New York, 1999.
39. Schalley, C. A.; Wesendrup, R.; Schroeder, D.; Schwarz, H. Organometallics 1996, 15, 678.
40. Scatterfeld, C. N.; Yeung, R. S. C. Ind. Eng. Chem. Fundam. 1963, 2, 257.
41. Schulz, P. A.; Mead, R. D.; Jones, P. L.; Lineberger, W. C. J. Chem. Phys. 1982, 77, 1153.
42. Gas-Phase Ion-Molecule Reaction Rate Constants Through 1986; Ikezoe, Y., Matsuoka, S., Takebe, M., Viggiano, A., Eds.; Ion Reaction Research Group of the Mass Spectroscopy Society of Japan: Maruzen, Tokyo, 1986.
43. -1. It is pleasing that the new value falls within the stated uncertainty of the old; however, we choose the more precisely determined new value to anchor the thermochemistry in this work.