Conformational analysis of 2-formylselenophene by means of 13C1H, 13C13C, and 77Se1H spinspin coupling constants

Australian Journal of Chemistry

Volumn 62, Issue 7, 2009, Pages 734-738

  Rusakov, Yury Yu ^a   Krivdin, Leonid B ^a   Istomina, Natalia V ^a   Levanova, Ekaterina P ^a   Levkovskaya, Galina G ^a  

^a A E FAVORSKY IRKUTSK INSTITUTE OF CHEMISTRY   (Russian Federation)

Author keywords

[No Author keywords available]

Indexed keywords

CONFORMATIONAL ANALYSIS; EXPERIMENTAL MEASUREMENTS; FORMYL GROUP; INTERNAL ROTATIONS; SPIN-SPIN COUPLING CONSTANTS;

SELENIUM; SELENIUM COMPOUNDS;

CONFORMATIONS;

EID: 67949091070     PISSN: 00049425     EISSN: None     Source Type: Journal    
DOI: 10.1071/CH09010     Document Type: Article

References (23)

1. Yu. Yu. Rusakov, L. B. Krivdin, N. V. Istomina, V. A. Potapov, S. V. Amosova, Magn. Reson. Chem. 2008, 46, 979. doi:10.1002/ MRC.2291
2. C. W. Nogueira, G. Zeni, J. B. T. Rocha, Chem. Rev. 2004, 104, 6255. doi:10.1021/CR0406559
3. (a) L. B. Krivdin, Yu. Yu. Rusakov, E. Yu. Schmidt, A. I. Mikhaleva, B. A. Trofimov, Aust. J. Chem. 2007, 60, 583. doi:10.1071/CH07086
4. (b) S. V. Fedorov, L. B. Krivdin, Yu. Yu. Rusakov, I. A. Ushakov, N. V. Istomina, N. A. Belogorlova, S. F. Malysheva, N. K. Gusarova, B. A. Trofimov, Magn. Reson. Chem. 2009, 47, 288. doi:10.1002/ MRC.2386
5. M. P. Simonnin, M. J. Pouet, J. M. Cense, C. Paulmier, Org. Magn. Reson. 1976, 8, 508. doi:10.1002/MRC.1270081005
6. (a) E. S. Nielsen, P. Jørgensen, J. Oddershede, J. Chem. Phys. 1980, 73, 6238. doi:10.1063/1.440119
7. (b) K. L. Bak, H. Koch, J. Oddershede, O. Christiansen, S. P.A. Sauer, J. Chem. Phys. 2000, 112, 4173. doi:10.1063/1.480963
8. (c) M. J. Packer, E. K. Dalskov, T. Enevoldsen, H. J. A. Jensen, J. Oddershede, J. Chem. Phys. 1996, 105, 5886. doi:10.1063/1.472430
9. (d) T. Enevoldsen, J. Oddershede, S. P. A. Sauer, Theor. Chem. Acc. 1998, 100, 275. doi:10.1007/S002140050388
10. P. F. Provasi, G. A. Aucar, S. P. A. Sauer, J. Chem. Phys. 2001, 115, 1324. doi:10.1063/1.1379331
11. (a) R. H. Contreras, J. E. Peralta, Prog. Nucl. Magn. Reson. Spectrosc. 2000, 37, 321. doi:10.1016/S0079-6565(00)00027-3
12. (b) R. H. Contreras, V. Barone, J. C. Facelli, J. E. Peralta, Ann. Rep. NMR Spectrosc. 2003, 51, 167. doi:10.1016/S0066-4103(03) 51004-3
13. (c) L. B. Krivdin, R. H. Contreras, Ann. Rep. NMR Spectrosc. 2007, 61, 133. doi:10.1016/S0066-4103(07)61103-X
14. (d) L. B. Krivdin, G.A. Kalabin, Prog. Nucl. Magn. Reson. Spectrosc. 1989, 21, 293. doi:10.1016/0079-6565(89)80007-X
15. M. W. Schmidt, K. K. Baldridge, J. A. Boatz, S. T. Elbert, M. S. Gordon, J. H. Jensen, S. Koseki, N. Matsunaga, K. A. Nguyen, S. Su, T. L. Windus, M. Dupuis, J. A. Montgomery, Jr, J. Comput. Chem. 1993, 14, 1347. doi:10.1002/JCC.540141112
16. C. Møller, M. S. Plesset, Phys. Rev. 1934, 46, 618. doi:10.1103/PHYSREV.46.618
17. R. Krishnan, J. S. Binkley, R. Seeger, J.A. Pople, J. Chem. Phys. 1980, 72, 650. doi:10.1063/1.438955
18. Dalton, A Molecular Electronic Structure Program, Release 2.0 2005, see http://www.kjemi.uio.no/software/dalton/dalton.html (Verified 25 May 2009).
19. (a) T. H. Dunning, Jr, J. Chem. Phys. 1989, 90, 1007. doi:10.1063/1.456153
20. (b) R. A. Kendall, T. H. Dunning, Jr, R. J. Harrison, J. Chem. Phys. 1992, 96, 6796. doi:10.1063/1.462569
21. (c) D. E. Woon, T. H. Dunning, Jr, J. Chem. Phys. 1993, 98, 1358. doi:10.1063/1.464303
22. Yu. K. Yur'ev, N. N. Mezentseva, Zh. Obsch. Khim. 1957, 27, 179.
23. E.N.Deryagina,E.N.Sukhomazova, E.P.Levanova,N.A.Korchevin, A. P. Danilova, Russ. J. Gen. Chem. 2004, 40, 290.