Infrared matrix isolation and theoretical studies on glutarimide

Journal of Physical Chemistry A

Volumn 101, Issue 42, 1997, Pages 7834-7841

  Bienko D C ^a   Michalska, D ^a   Roszak, S ^a   Wojciechowski, W ^a   Nowak, M J ^b   Lapinski, L ^b  

^a WROCLAW UNIVERSITY OF TECHNOLOGY   (Poland)

^b INSTITUTE OF PHYSICS   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; INFRARED SPECTROSCOPY; MOLECULAR STRUCTURE; MOLECULAR VIBRATIONS; PERTURBATION TECHNIQUES;

DENSITY FUNCTIONAL THEORY; GLUTARIMIDE; HARTREE FOCK THEORY; MOLLER PLESSET PERTURBATION METHOD; POTENTIAL ENERGY DISTRIBUTION (PED);

KETONES;

EID: 0031249299     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp970726q     Document Type: Article

References (58)

1. Rahman, A.; Luc, P.-V. T.; Schein, P. S.; Woolley, P. V. Cancer Res. 1984, 44, 149.
2. (a) Harris, A. I. Drugs Today 1984, 20, 167.
3. (b) Gale, K. E.; Andersen, J. W.; Tormey, D. C.; Mansour, E. G.; Davis, T. E.; Horton, J.; Wolter, J. M.; Smith, T. J.; Cummings, F. J. Cancer 1994, 73, 354.
4. (a) Burzynski, S. R. Adv. Exp. Clin. Chemother. 1988, 6, 45.
5. (b) Burzynski, S. R.; Hai, T. T. Drugs Fut. 1985, 10, 103.
6. (a) Tsuda, H.; Sugihara, S.; Nishida, H.; Hara, H.; Eriguchi, N.; Ishii, K.; Sasaki, K.; Yoshimura, S.; Tanaka, N. Jpn. J. Cancer Res. 1992, 83, 527.
7. (b) Yoshida, H.; Nishida, H.; Kitsuu, T.; Fukushima, K.; Eriguchi, N.; Hara, H.; Nakayama, T.; Ohishi, K.; Tsuda, H. J. Jpn. Soc. Cancer Ther. 1992, 27, 1943.
8. (a) Lehner, A. F.; Burzynski, S. R.; Hendry, L. B. Drugs Exp. Clin. Res. 1986, 12 (Suppl. 1), 57.
9. (b) Hendry, L. B.; Muldoon, T. G.; Burzynski, S. R.; Copland, J. A.; Lehner, A. F. Drugs Exp. Clin. Res. 1987, 13 (Suppl. 1) 77.
10. (b) Hendry, L. B.; Muldoon, T. G. J. Steroid Biochem. 1988, 30, 325.
11. Eriguchi, N.; Hara, H.; Yoshida, H., Nishida, H.; Nakayama, T.; Ohishi, K.; Tsuda, H.; Ikeda, I. J. Jpn. Soc. Cancer Ther. 1988, 23, 1560.
12. Otani, T.; Minami, Y.; Matsumoto, H.; Marunaka, T.; Lou, Z.-X.; Yu, Q.-W. J. Antibiot. 1989, 42, 654.
13. Sugawara, K.; Nishiyama, Y.; Toda, S.; Komiyama, N.; Hatori, M.; Moriyama, T.; Sawada, Y.; Kamei, H.; Konishi, M.; Oki, T. J. Antibiot. 1992, 45, 1433.
14. (a) Sonoda, T.; Osada, H.; Uzawa, J.; Isono, K. J. Antibiot. 1991, 44, 160.
15. (b) Sonoda, T.; Kobayashi, K.; Ubukata, M.; Osada, H.; Isono, K. J. Antibiot. 1992, 45, 1963.
16. Carrasco, L.; Jimenez, A.; Vazquez, D. Eur. J. Biochem. 1976, 64, 1.
17. Bottger, E. C.; Blanar, M. A.; Flavell, R. A. Immunogenetics 1988, 28, 215.
18. Shull, G. E. J. Theor. Biol. 1984, 110, 461.
19. Grollman, A. P. Biochemistry 1966, 56, 1867.
20. Xu, S.; Clark, L. B. J. Am. Chem. Soc. 1994, 116, 9227.
21. Thompson, J. W., Jr.; Leroi, G. E.; Popov, A. I. Spectrochim. Acta 1975, 31, 1553.
22. Szczesniak, M.; Nowak, M. J.; Rostkowska, H.; Szczepaniak, K.; Person, W. B.; Shugar, D. J. Am. Chem. Soc. 1983, 105, 5969.
23. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robs, M. A.; Cheeseman, J. R.; Keith, T.; Petersson, J. A.; Mongomery, K.; Raghavachari, K.; Al.-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andres, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; DeFrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzales, C.; Pople, J. A. Gaussian 94, Revision B.3; Gaussian, Inc.: Pittsburgh, 1995.
24. Møller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618.
25. Parr, R. G.; Yang, W. Density Functional Theory of Atoms and Molecules; Oxford University Press: Oxford, 1989.
26. Huzinaga, S. J. Chem. Phys. 1965, 42, 1293.
27. Dunning, T. H.; Hay, P. J. In Modern Theoretical Chemistry; Schaefer, H. F., III, Ed.; Plenum Press: New York, 1976; Vol. 3, p 1.
28. Hariharan P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213.
29. Szostak, M. M.; Misiaszek, T.; Roszak, S.; Rankin, J. G.; Czernuszewicz, R. S. J. Phys. Chem. 1995, 99, 14992.
30. Nowak, M. J.; Lapinski, L.; Bieńko, D. C.; Michalska, D. Spectrochim. Acta 1997, 53A, 856.
31. Becke, A. D. Phys. Rev. A 1988, 38, 3098.
32. Perdew, J. P. Phys. Rev. B 1986, 33, 8822.
33. Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B 1988, 37, 785.
34. Becke, A. D. J. Chem. Phys. 1993, 98, 5648.
35. Kohn, W.; Sham, L. J. Phys. Rev. 1965, 140, 1133.
36. Fogarasi, G,; Pulay, P. In Vibrational Spectra and Structure; Durig, J. R., Ed.; Elsevier: New York, 1985; Vol 13.
37. Schachtschneider, J. H. Vibrational Analysis of Polyatomic Molecules. Technical Report Nos. 231-64 and 57-65, Shell Development Co., Emeryville, CA, 1970.
38. Califano, S. Vibrational States; Wiley: New York, 1976.
39. (a) Morino, Y.; Kuchitsu, J. J. Chem. Phys. 1952, 20, 1809.
40. (b) Keresztury, G.; Jalsovszky, G. J. Mol. Struct. 1971, 10, 304.
41. Kwiatkowski, J. S.; Leszczyński, J. J. Mol. Struct. (THEOCHEM) 1994, 312, 201.
42. (a) Lapinski, L.; Nowak, M. J.; Leś, A.; Adamowicz, L. Vib. Spectrosc. 1995, 8, 331.
43. (b) Nowak, M. J.; Lapinski, L.; Fulara, J. Leś, A.; Adamowicz, L. J. Phys. Chem. 1992, 96, 1562.
44. Leś, A.; Adamowicz, L.; Nowak, M. J.; Lapinski, L. Spectrochim. Acta 1992, 48A, 1385.
45. Barnes, A. J.; Stuckey, M. A.; Le Gall L. Spectrochim. Acta 1984, 40A, 419.
46. Petersen, C. S. Acta Chem. Scand. 1971, 25, 379.
47. Michalska, D.; Morzyk, B.; Wojciechowski, W.; Głowiak, T. Inorg. Chim. Acta 1995, 248, 159.
48. Bellamy, L. J. The Infrared Spectra of Complex Molecules, Chapman and Hall Press: London, 1975; Chapters 2, 5, and 12.
49. Hess, B. A., Jr.; Allen, W. D.; Michalska, D.; Schaad, L. J.; Schaefer H. F., III. J. Am. Chem. Soc. 1987, 109, 1615.
50. Michalska, D.; Chojnacki, H.; Hess, B. A., Jr.; Schaad, L. J. Chem. Phys. Lett. 1987, 141, 376.
51. Michalska, D.; Bieńko, D. C.; Abkowicz-Bieńko, A. J.; Latajka, Z. J. Phys. Chem. 1996, 100, 17786.
52. Szczesniak, M.; Nowak, M. J.; Szczepaniak, K.; Chin, S.; Scott, I.; Person, W. B. Spectrochim. Acta 1985, 41A, 223.
53. Szczesniak, M.; Nowak, M. J.; Szczepaniak, K.; Person, W. B. Spectrochim. Acta 1985, 41A, 237.
54. Wojcik, M. J.; Rostkowska, H.; Szczepaniak, K.; Person, W. B. Spectrochim. Acta 1989, 45A, 499.
55. Morzyk, B. Ph.D. Thesis, Technical University of Wroclaw, Wroclaw, 1996.
56. Michalska, D.; Spectrochim. Acta 1993, 49A, 303.
57. Wiberg, K. B.; Shrake, A. Spectrochim. Acta 1973, 29A, 583.
58. Michalska, D.; Drugs Exp. Clin. Res. 1990, 16, 343.