SCOPUS 정보 검색 플랫폼

Journal of Organic Chemistry

Volumn 62, Issue 21, 1997, Pages 7305-7309

13C and 15N Kinetic Isotope Effects on the Decarboxylation of 3-Carboxybenzisoxazole. Theory vs Experiment

(2) Czyryca, P a Paneth, P a

a LODZ UNIVERSITY OF TECHNOLOGY (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000837728 PISSN: 00223263 EISSN: None Source Type: Journal
DOI: 10.1021/jo970852q Document Type: Article

Times cited : (14)

References (61)

1
- 0029270320
- and references therein
- (a) Paneth, P. Comput. Chem. 1995, 19, 11-20 and references therein,
- (1995) Comput. Chem. , vol.19 , pp. 11-20
- Paneth, P.¹

2
- 0007414524
- (b) Gawlita, E.; Szylhabel-Godala, A.; Paneth, P. J. Phys. Org. Chem. 1996, 9, 41-49.
- (1996) J. Phys. Org. Chem. , vol.9 , pp. 41-49
- Gawlita, E.¹ Szylhabel-Godala, A.² Paneth, P.³

3
- 1542530159
- Carbondale, 1994, ARI-CD 101, ARInternet Corporation: Landover, MD
- (c) Czyryca, P.; Paneth, P. Proceedings of 1st Electronic Computational Chemistry Conference; Carbondale, 1994, ARI-CD 101, ARInternet Corporation: Landover, MD, 1996.
- (1996) Proceedings of 1st Electronic Computational Chemistry Conference
- Czyryca, P.¹ Paneth, P.²

4
- 0009086492
- (d) Czyryca, P.; Paneth, P. J. Mol. Struct. (Theochem) 1996, 370, 237-243.
- (1996) J. Mol. Struct. (Theochem) , vol.370 , pp. 237-243
- Czyryca, P.¹ Paneth, P.²

5
- 0002839704
- (e) Rakowski, K.; Paneth, P. J. Mol. Struct. 1996, 378, 35-43.
- (1996) J. Mol. Struct. , vol.378 , pp. 35-43
- Rakowski, K.¹ Paneth, P.²

6
- 0028566071
- (f) Gawlita, E.; Anderson, V. E.; Paneth, P. Eur. Biophys. J. 1994, 23, 353-360.
- (1994) Eur. Biophys. J. , vol.23 , pp. 353-360
- Gawlita, E.¹ Anderson, V.E.² Paneth, P.³

7
- 0042680123
- (g) Paneth, P. J. Mol. Struct. 1994, 321, 35-40.
- (1994) J. Mol. Struct. , vol.321 , pp. 35-40
- Paneth, P.¹

8
- 0001005691
- (a) Olson, L. P.; Niwayama, S.; Yoo, H.-Y.; Houk, K. N.; Harris, N. J.; Gajewski, J. J. J. Am. Chem. Soc. 1996, 118, 886-892.
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 886-892
- Olson, L.P.¹ Niwayama, S.² Yoo, H.-Y.³ Houk, K.N.⁴ Harris, N.J.⁵ Gajewski, J.J.⁶

9
- 0029174681
- (b) Wiest, O.; Houk, K. N. J. Am. Chem. Soc. 1995, 117, 11628-11639.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 11628-11639
- Wiest, O.¹ Houk, K.N.²

10
- 0001461906
- (c) Wiest, O.; Black, K. A.; Houk, K. N.; J. Am. Chem. Soc. 1994, 116, 10336-10337.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 10336-10337
- Wiest, O.¹ Black, K.A.² Houk, K.N.³

11
- 0001474574
- (d) Storer, J. W.; Raimondi, L.; Houk, K. N.; J. Am. Chem. Soc. 1994, 116, 9675-9683.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 9675-9683
- Storer, J.W.¹ Raimondi, L.² Houk, K.N.³

12
- 37049073683
- (e) Houk, K. N.; Li, Y.; Storer, J.; Raimondi, L.; Beno, B. J. Chem. Soc. Faraday Trans. 1994, 90, 1599-1604.
- (1994) J. Chem. Soc. Faraday Trans. , vol.90 , pp. 1599-1604
- Houk, K.N.¹ Li, Y.² Storer, J.³ Raimondi, L.⁴ Beno, B.⁵

13
- 0000205622
- (f) Wiest, O.; Houk, K. N.; Black, K. A.; Thomas, B. J. Am. Chem. Soc. 1995, 117, 8594-8599.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 8594-8599
- Wiest, O.¹ Houk, K.N.² Black, K.A.³ Thomas, B.⁴

14
- 0001312278
- (g) Olson, L. P.; Li, Y.; Houk, K. N.; Kresge, A. J.; Schaad, L. J. J. Am. Chem. Soc. 1995, 117, 2992-2997.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 2992-2997
- Olson, L.P.¹ Li, Y.² Houk, K.N.³ Kresge, A.J.⁴ Schaad, L.J.⁵

15
- 0000466261
- (h) Yoo, H. Y.; Houk, K. N. J. Am. Chem. Soc. 1994, 116, 12047-12048.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 12047-12048
- Yoo, H.Y.¹ Houk, K.N.²

16
- 0000923339
- (i) Houk, K. N.; Li, Y.; Mcallister, M. A.; Odoherty, G.; Paquette, L. A. J. Am. Chem. Soc. 1994, 116, 10895-10913.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 10895-10913
- Houk, K.N.¹ Li, Y.² Mcallister, M.A.³ Odoherty, G.⁴ Paquette, L.A.⁵

17
- 0029917440
- (j) Bero, B. R.; Houk, K. N.; Singleton, D. A. J. Am. Chem. Soc. 1996, 118, 9984-9985.
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 9984-9985
- Bero, B.R.¹ Houk, K.N.² Singleton, D.A.³

18
- 0001076930
- (k) Zipse, H.; Apaydin, G.; Houk, K. N. J. Am. Chem. Soc. 1995, 117, 8608-8617. l/ Goldstein, E.; Beno, B.; Houk, K. N.; J. Am. Chem. Soc. 1996, 118, 6036-6043.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 8608-8617
- Zipse, H.¹ Apaydin, G.² Houk, K.N.³

19
- 0030018945
- (k) Zipse, H.; Apaydin, G.; Houk, K. N. J. Am. Chem. Soc. 1995, 117, 8608-8617. l/ Goldstein, E.; Beno, B.; Houk, K. N.; J. Am. Chem. Soc. 1996, 118, 6036-6043.
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 6036-6043
- Goldstein, E.¹ Beno, B.² Houk, K.N.³

20
- 0342291341
- (a) Lynch, G. C.; Truhlar, D. G.; Brown, F. B.; Zhao, J. G. Hyperfine Interactions 1994, 87, 885-898.
- (1994) Hyperfine Interactions , vol.87 , pp. 885-898
- Lynch, G.C.¹ Truhlar, D.G.² Brown, F.B.³ Zhao, J.G.⁴

21
- 0029405807
- (b) Hu, W. P.; Truhlar, D. G. J. Am. Chem. Soc. 1995, 117, 10726-10734.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 10726-10734
- Hu, W.P.¹ Truhlar, D.G.²

22
- 0029635994
- (c) Lynch, G. C.; Truhlar, D. G.; Brown, F. B.; Zhao, J. G. J. Phys. Chem. 1995, 99, 207-225.
- (1995) J. Phys. Chem. , vol.99 , pp. 207-225
- Lynch, G.C.¹ Truhlar, D.G.² Brown, F.B.³ Zhao, J.G.⁴

23
- 33750105711
- (d) Allison, T. C.; Lynch, G. C.; Truhlar, D. G.; Gordon, M. S. J. Phys. Chem. 1996, 100, 13588-13593.
- (1996) J. Phys. Chem. , vol.100 , pp. 13588-13593
- Allison, T.C.¹ Lynch, G.C.² Truhlar, D.G.³ Gordon, M.S.⁴

24
- 36449006284
- (e) Melissas, V. S.; Truhlar, D. G. J. Chem. Phys. 1993, 99, 3542.
- (1993) J. Chem. Phys. , vol.99 , pp. 3542
- Melissas, V.S.¹ Truhlar, D.G.²

25
- 33748403390
- (a) Glad, S. S.; Jensen, F. J. Phys. Chem. 1996, 100, 16892-16898.
- (1996) J. Phys. Chem. , vol.100 , pp. 16892-16898
- Glad, S.S.¹ Jensen, F.²

26
- 0029844520
- (b) Nielsen, P. A.; Glad, S. S.; Jensen, F. J. Am. Chem. Soc. 1996, 118, 10577-10583.
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 10577-10583
- Nielsen, P.A.¹ Glad, S.S.² Jensen, F.³

27
- 0001562923
- (c) Glad, S. S.; Jensen, F. J. Am. Chem. Soc. 1997, 119, 227-232.
- (1997) J. Am. Chem. Soc. , vol.119 , pp. 227-232
- Glad, S.S.¹ Jensen, F.²

28
- 37049090722
- (d) Glad, S. S.; Jensen, F. J. Chem. Soc., Perkin Trans 2 1994, 4, 871-876.
- (1994) J. Chem. Soc., Perkin Trans 2 , vol.4 , pp. 871-876
- Glad, S.S.¹ Jensen, F.²

29
- 2642662943
- (e) Glad, S. S.; Jensen, F. J. Am. Chem. Soc. 1994, 116, 9302-9310.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 9302-9310
- Glad, S.S.¹ Jensen, F.²

30
- 0031055521
- (a) Rising, K. A.; Schramm, V. L. J. Am. Chem. Soc. 1997, 119, 27-37.
- (1997) J. Am. Chem. Soc. , vol.119 , pp. 27-37
- Rising, K.A.¹ Schramm, V.L.²

31
- 0029971658
- (b) Huskey, W. P. J. Am. Chem. Soc. 1996, 118, 1663-1668.
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 1663-1668
- Huskey, W.P.¹

32
- 0041976510
- (c) Yamataka, H.; Mishima, M.; Kuwatani, Y.; Tsuno, Y. J. Am. Chem. Soc. 1995, 117, 5829-5831.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 5829-5831
- Yamataka, H.¹ Mishima, M.² Kuwatani, Y.³ Tsuno, Y.⁴

33
- 0344994432
- (d) Kupczyk-Subotkowska, L.; Saunders, W. H., Jr.; Shine, H. J.; Subotkowski, W. J. Am. Chem. Soc. 1994, 116, 7088-7093.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 7088-7093
- Kupczyk-Subotkowska, L.¹ Saunders Jr., W.H.² Shine, H.J.³ Subotkowski, W.⁴

34
- 0000426423
- (e) Boyd, R. J.; Kim, C.-K.; Shi, Z.; Weinberg, N.; Wolfe, S. J. Am. Chem. Soc. 1993, 115, 10147-10152.
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 10147-10152
- Boyd, R.J.¹ Kim, C.-K.² Shi, Z.³ Weinberg, N.⁴ Wolfe, S.⁵

35
- 0142056653
- Szylhabel-Godala, A.; Madhavan, S.; Rudziñski, J.; O'Leary, M. H.; Paneth, P. J. Phys. Org. Chem. 1996, 9, 35-40.
- (1996) J. Phys. Org. Chem. , vol.9 , pp. 35-40
- Szylhabel-Godala, A.¹ Madhavan, S.² Rudziñski, J.³ O'Leary, M.H.⁴ Paneth, P.⁵

36
- 33847802171
- Kemp, D. S.; Paul, K. G. J. Am. Chem. Soc. 1975, 97, 7305-7312.
- (1975) J. Am. Chem. Soc. , vol.97 , pp. 7305-7312
- Kemp, D.S.¹ Paul, K.G.²

37
- 0000467257
- Kemp, D. S.; Cox, D. D.; Paul, K. G. J. Am. Chem. Soc. 1975, 97, 7312-7318.
- (1975) J. Am. Chem. Soc. , vol.97 , pp. 7312-7318
- Kemp, D.S.¹ Cox, D.D.² Paul, K.G.³

38
- 0025862151
- Lewis, C.; Kramer, T.; Robinson, S.; Hilvert, D. Science 1991, 253, 1019-1022.
- (1991) Science , vol.253 , pp. 1019-1022
- Lewis, C.¹ Kramer, T.² Robinson, S.³ Hilvert, D.⁴

39
- 0000787159
- Lewis, C.; Paneth, P.; O'Leary, M. H.; Hilvert, D. J. Am. Chem. Soc. 1993, 115, 1410-1412.
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 1410-1412
- Lewis, C.¹ Paneth, P.² O'Leary, M.H.³ Hilvert, D.⁴

40
- 5244287607
- Gao, J. J. Am. Chem. Soc. 1995, 117, 8600-8607.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 8600-8607
- Gao, J.¹

41
- 0003510786
- Grate, J. W.; Mcgill, R. A.; Hilvert, D. J. Am. Chem. Soc. 1993, 115, 8577-8584.
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 8577-8584
- Grate, J.W.¹ Mcgill, R.A.² Hilvert, D.³

42
- 37049071278
- Famini, G. R.; Wilson, L. Y. J. Chem. Soc., Perkin Trans 2. 1994, 1641-1650.
- (1994) J. Chem. Soc., Perkin Trans 2. , pp. 1641-1650
- Famini, G.R.¹ Wilson, L.Y.²

43
- 0028032221
- Tarasow, T. M.; Levis. C.; Hilvert, D. J. Am. Chem. Soc. 1994, 116, 7959-7964.
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 7959-7964
- Tarasow, T.M.¹ Levis, C.² Hilvert, D.³

44
- 0018890517
- O'Leary, M. H. Methods Enzymol. 1980, 64, 83-104.
- (1980) Methods Enzymol. , vol.64 , pp. 83-104
- O'Leary, M.H.¹

45
- 0003909732
- Ronald Press Co.: New York
- Melander, L. Isotope Effects on Reaction Rates; Ronald Press Co.: New York, 1960.
- (1960) Isotope Effects on Reaction Rates
- Melander, L.¹

46
- 0003847631
- Stewart, J. J. P., Fujitsu, MOPAC 93 rev. 2, 1993.
- (1993) Fujitsu, MOPAC 93 Rev. 2
- Stewart, J.J.P.¹

47
- 1542635095
- Amsol 5.4, QCPE program 606
- Hawkins, G. D.; Lynch, G. C.; Giesen, D. J.; Rossi, I.; Storer, J. W.; Liotard, D. A.; Cramer, C. J.; Truhlar, D. G. Amsol 5.4, QCPE program 606.
- Hawkins, G.D.¹ Lynch, G.C.² Giesen, D.J.³ Rossi, I.⁴ Storer, J.W.⁵ Liotard, D.A.⁶ Cramer, C.J.⁷ Truhlar, D.G.⁸

48
- 1542740317
- AMPAC 5.0, Semichem, 7128 Summit, Shawnee, KS 66216
- AMPAC 5.0, Semichem, 7128 Summit, Shawnee, KS 66216.

49
- 0004133516
- 1995, Gaussian, Inc., Pittsburgh PA
- Frisch, M. J.; Trucks, G. W.; Schlegel H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, 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. J. P.; Head-Gordon, M.; Gonzalez, C.; Pople, J. A. Gaussian 94, Revision C.3, 1995, Gaussian, Inc., Pittsburgh PA, 1995.
- (1995) Gaussian 94, Revision C.3
- Frisch, M.J.¹ Trucks, G.W.² Schlegel, H.B.³ Gill, P.M.W.⁴ Johnson, B.G.⁵ Robb, M.A.⁶ Cheeseman, J.R.⁷ Keith, T.⁸ Petersson, G.A.⁹ Montgomery, J.A.¹⁰ Raghavachari, K.¹¹ Al-Laham, M.A.¹² Zakrzewski, V.G.¹³ Ortiz, J.V.¹⁴ Foresman, J.B.¹⁵ Cioslowski, J.¹⁶ Stefanov, B.B.¹⁷ Nanayakkara, A.¹⁸ Challacombe, M.¹⁹ Peng, C.Y.²⁰ more..

50
- 1542740308
- HyperChem 5.01a, Hypercube, Inc., Waterloo, Ontario, Canada N2L 3X2
- HyperChem 5.01a, Hypercube, Inc., Waterloo, Ontario, Canada N2L 3X2.

51
- 84893169025
- Schmidt, M. W.; Baldrige, K. K.; Boatz, J. A.; Elbert, S. T.; Gordon, M. S.; Jensen, J. H.; Koseki, S.; Matsunaga, N.; Nguyen, K. A.; Su, S. J.; Windus, T. L.; Dupuis, M.; Montgomery, J. A. J. Comput. Chem. 1993, 14, 1347-1363.
- (1993) J. Comput. Chem. , vol.14 , pp. 1347-1363
- Schmidt, M.W.¹ Baldrige, K.K.² Boatz, J.A.³ Elbert, S.T.⁴ Gordon, M.S.⁵ Jensen, J.H.⁶ Koseki, S.⁷ Matsunaga, N.⁸ Nguyen, K.A.⁹ Su, S.J.¹⁰ Windus, T.L.¹¹ Dupuis, M.¹² Montgomery, J.A.¹³

52
- 1542635091
- Paneth, P. ISOEFF version 6ha, available upon request from the author. This program extracts all data necessary for calculations of isotope effects from outputs of quantum chemistry packages and performs calculations of isotope effects; MOPAC/AMPAC, AMSOL, SIBIQ, GAMESS, GAUSSIAN and HYPERCHEM formats are currently supported.
- ISOEFF Version 6ha
- Paneth, P.¹

53
- 84961980743
- Klamt, A.; Shüürman, G. J. Chem. Soc., Perkin Trans. 2 1993, 799-805.
- (1993) J. Chem. Soc., Perkin Trans. 2 , pp. 799-805
- Klamt, A.¹ Shüürman, G.²

54
- 0000187318
- Giesen, D. J.; Storer, J. W.; Cramer, C. J.; Truhlar, D. G. J. Am. Chem. Soc. 1995, 117, 1057-1068.
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 1057-1068
- Giesen, D.J.¹ Storer, J.W.² Cramer, C.J.³ Truhlar, D.G.⁴

55
- 0842341771
- Dewar, M. J .S.; Zoebisch, E. G.; Healy, E. F.; Stewart, J. J. P. J. Am. Chem. Soc. 1985, 107, 3902.
- (1985) J. Am. Chem. Soc. , vol.107 , pp. 3902
- Dewar, M.J.S.¹ Zoebisch, E.G.² Healy, E.F.³ Stewart, J.J.P.⁴

56
- 0004016501
- Jorgensen, W. L.; Chandrasekhas, J.; Madura, J. D.; Impley, R. W.; Klein, M. L. J. Chem. Phys. 1983, 79, 926.
- (1983) J. Chem. Phys. , vol.79 , pp. 926
- Jorgensen, W.L.¹ Chandrasekhas, J.² Madura, J.D.³ Impley, R.W.⁴ Klein, M.L.⁵

57
- 1542740315
- Paneth, P.; O'Leary, M. H. Biochemistry 1985, 24, 5145-5147.
- (1985) Biochemistry , vol.24 , pp. 5145-5147
- Paneth, P.¹ O'Leary, M.H.²

58
- 0000798542
- Headley, G. W.; O'Leary, M. H. J. Am. Chem. Soc. 1990, 112, 1894.
- (1990) J. Am. Chem. Soc. , vol.112 , pp. 1894
- Headley, G.W.¹ O'Leary, M.H.²

59
- 84988129057
- Stewart, J. J. P. J. Comput. Chem. 1989, 10, 209, 221.
- (1989) J. Comput. Chem. , vol.10 , pp. 209
- Stewart, J.J.P.¹

60
- 37049095120
- Bayles, J. W.; Bron, J.; Paul, S. O. J. Chem. Soc., Faraday Trans. 1976, 72, 1546-1552.
- (1976) J. Chem. Soc., Faraday Trans. , vol.72 , pp. 1546-1552
- Bayles, J.W.¹ Bron, J.² Paul, S.O.³

61
- 0011083273
- Scott, A. F.; Random, L. J. Phys. Chem. 1996, 100, 16502-16513
- (1996) J. Phys. Chem. , vol.100 , pp. 16502-16513
- Scott, A.F.¹ Radom, L.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.