Environmental effects on the formation of the primary and secondary ozonides of ethylene at cryogenic temperatures

Journal of the American Chemical Society

Volumn 118, Issue 15, 1996, Pages 3687-3693

  Samuni, U ^a   Fraenkel, R ^a   Haas, Y ^a   Fajgar, R ^b   Pola, J ^b  

^a HEBREW UNIVERSITY OF JERUSALEM   (Israel)

^b INSTITUTE OF CHEMICAL PROCESS FUNDAMENTALS   (Czech Republic)

Author keywords

[No Author keywords available]

Indexed keywords

ETHYLENE; OZONE;

ARTICLE; COMPUTER SIMULATION; DRUG MIXTURE; INFRARED SPECTROPHOTOMETRY; MOLECULAR DYNAMICS; REACTION ANALYSIS; TEMPERATURE;

EID: 0029895128     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja9532852     Document Type: Article

References (41)

1. Criegee, R Rec. Chem. Prog. 1957, 18, 111.
2. Kuczkowski, R. Chem. Soc. Rev. 1992, 79.
3. Criegee, R. In Peroxide Reaction Mechanisms; Edwards, J. O., Ed.; Wiley-Imerscience: New York, 1960; p 29.
4. Gillies, C. W.; Kuczkowski, R. L. J. Am. Chem. Soc. 1972, 94, 6337, 7609.
5. Latimer, R.; Kuczkowski, R. L., Gillies, C. W. J. Am. Chem Soc. 1974, 96, 348.
6. Kühne, H., Gunthard, Hs. H. J. Phys. Chem. 1976, 80, 1238.
7. Greenwood, F. L. J. Org, Chem. 1965, 30, 3108. Greenwood, F L., Durham, L. J. J. Org Chem. 1969, 34, 3363.
8. Greenwood, F. L. J. Org, Chem. 1965, 30, 3108. Greenwood, F L., Durham, L. J. J. Org Chem. 1969, 34, 3363.
9. Hull, L A., Hisatsune, I. C , Heicklen, J. J. Am. Chem. Soc. 1972, 94, 4856.
10. Nelander, B.; Nord, L. Tetrahedron Lett. 1977, 32, 2821.
11. Kohlmiller, C. K.; Andrews, L. J. Am. Chem. Soc. 1981, 103, 2578.
12. Gillies, J. Z.; Gillies. C. W.; Suenram, R. D., Lovas, F. J. J. Am. Chem. Soc. 1988, 110, 7991.
13. Sander, W. Angew. Chem., Int. Ed. Engl. 1990, 29, 344
14. Gillies, C. W., Gillies, J. Z.; Suenram, R. D.; Lovas, F. J.; Kraka, E., Cremer, D J Am. Chem. Soc. 1991, 113, 2412
15. Lovas, F. J.; Suenram, R. B. Chem Phys. 1977, 51, 453. Suenram, R B.; Lovas, F. J. J. Am. Chem. Soc. 1978, 100, 5117.
16. Lovas, F. J.; Suenram, R. B. Chem Phys. 1977, 51, 453. Suenram, R B.; Lovas, F. J. J. Am. Chem. Soc. 1978, 100, 5117.
17. Dewar, M. J. S.; Hwang, J. C.; Kuhn, D. R. J. Am. Chem. Soc. 1991, 113, 735.
18. Cremer, D J. Chem. Phys. 1978, 69, 4456, 1978, 70, 1898.
19. Cremer, D J. Chem. Phys. 1978, 69, 4456, 1978, 70, 1898.
20. McKee, M. L , Rohlfig, C. L. J. Am. Chem. Soc. 1989, 111, 2497.
21. Fraenkel, R.; Haas, Y. Chem Phys. 1994, 186, 185.
22. Allen, M P., Tildesley, D. J. Computer Simulations of Liquids; Oxford University New York, 1987
23. Fraenkel, R , Haas, Y. To be submitted for publication.
24. Frisch, M. J.; Trucks, G. W.; Gordon-Head, M.; Gill, P. M. W.; Wong, M. W.; Foresman, J. B.; Johnson, B. G., Schlegel, H. B.; Robb, M. A.; Replogle, E. S.; Gomperts, R.; Andres, J. L.; Raghavachari, K.; Binkley, J. S.; Gonzalez, C.; Martin, R. L.; Fox, D. J.; Defrees, D. J.; Baker, J , Stewart, J. J. P.; Pople, J. A Gaussian 92, Revision F2; Gaussian, Inc.: Pittsburg, PA, 1992.
25. Hehre, W. J.; Ditchfield, R., Pople, J. A. J. Chem. Phys. 1972, 56, 2257
26. Pople, J. A.; Scott, A. P.; Wong, M. W.; Radom, L. Isr. J. Chem. 1993, 33, 345.
27. -1 (these values vary somewhat with deposition conditions).
28. Falk, M.; Seto, P. F Can. J. Spectrosc. 1986, 31, 134.
29. Falk, M Can. J. Chem. Phys. 1987, 86, 560.
30. Samuni, U.; Haas, Y. Spectrochim. Acta, in press.
31. The results of the SOZ ab initio calculations are available from the authors on request.
32. Lugez, C.; Schriver, A.; Levant, R.; Schriver-Mazzouh, L. Chem. Phys. 1994, 181, 129.
33. Thomas, S. G.; Guillory, W. A. J. Chem. Phys. 1973, 77, 2469.
34. Khoshkhoo, H.; Nixon, E R. Spectrochim. Acta 1973, 29A, 603.
35. Brosset, P.; Dahoo, R.; Gauthier-Roy, B , Abou af-Marsuin, L.; Lakhlifi, A. Chem. Phys. 1993, 172, 315.
36. Lakhlifi, A.; Girardet, C.; Dahoo, R.; Brosset, P , Gauthier-Roy, B., Abouaf-Marguin, L. Chem. Phys. 1993, 177, 31.
37. Pollack, G. L. Rev. Mod. Phys. 1964, 36, 748.
38. Löwen, H L.; Bier, K. D., Jodl, H. J., Löwenschuss, A.; Givan, A. J. Chem Phys. 1989, 90, 5309.
39. DeMore, W. B. Int J. Chem. Kinet. 1969, 1, 209.
40. Becker, K. H.; Schurath, U.; Seitz, H. Int J. Chem. Kinet. 1974, 6, 725.
41. Knözinger, E.; Schuller, W.; Langel, W. J. Phys Chem 1993, 97, 927.