Through space substituent effects shedding light on aromaticity. Energetic and geometric contributions to aromaticity

Polish Journal of Chemistry

Volumn 70, Issue 10, 1996, Pages 1351-1356

  Krygowski, T M ^a   Cyranski M ^a   Wisiorowski, M ^a  

^a UNIVERSITY OF WARSAW   (Poland)

Author keywords

Ab initio calculations; Aromaticity; Canonical structures; Conformations; Substituent effects

Indexed keywords

EID: 0037914238     PISSN: 01375083     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (25)

1. Krygowski T.M., Anulewicz R., Jarmuła A., Ba̧k T., Rasała D. and Howard S.T., Tetrahedron, 50, 13155 (1994).
2. Howard S.T., Krygowski T.M. and Główka M.L., Tetrahedron, 52, 000 (1996).
3. Krygowski T.M., Kruszewski J. and Anulewicz R., Acta Cryst., B39, 372 (1983).
4. Krygowski T.M., Anulewicz R. and Wisiorowski M., Polish J. Chem., 69, 1579 (1995).
5. Krygowski T.M., Anulewicz R. and Hiberty P.C., J. Org. Chem., submitted.
6. Elvidge J.A. and Jackman L.M., J. Chem. Soc., 859 (1961).
7. Sondheimer F. Pure Appl. Chem., 7, 363 (1964).
8. Julg A. and Francois Ph., Theor. Chim. Acta, 7, 249 (1967).
9. Kruszewski J and Krygowski T.M., Tetr. Letters, 3839 (1972).
10. Pozharski A.F. and Dalnikovskaya W., Usp. khim., 50, 1559 (1984).
11. Bird C.W., Tetrahedron, 41, 1409 (1985).
12. Krygowski T.M., J. Chem. Inf. Comput. Sci., 33, 70 (1993).
13. Krygowski T.M. and Cyrański M., Tetrahedron, 52, 1713 (1996).
14. Katritzky A.R., Barczyński P., Musumurra G., Pisano D. and Szafran M., J. Am. Chem. Soc., 111, 7 (1989).
15. Katritzky A.R., Feygelman V., Musumurra G., Barczyński P. and Szafran M., J. Prakt. Chem., 332, 853 (1990).
16. Katritzky A.R., Feygelman V., Musumurra G., Barczyński P. and Szafran M., J. Prakt. Chem., 332, 870 (1990).
17. Katritzky A.R. and Barczyński P., J. Prakt. Chem., 332, 885 (1990).
18. Jug K. and Koester A., J. Phys. Org. Chem., 4, 163 (1991).
19. Cyrański M. and Krygowski T.M., Polish J. Chem., 69, 1088 (1995).
20. Krygowski T.M., Ciesielski A. and Cyrański M., Chem. Papers (Bratislava), 49, 128 (1995).
21. Krygowski T.M., Ciesielski A., Bird C.W. and Kotschy A., J. Chem. Inf. Comput. Sci., 35, 203 (1995).
22. Zalewski R.I., chpt. in "Similarity Models in Organic Chemistry, Biochemistry and Related Fields", ȩds. R.I. Zalewski, T.M. Krygowski and J. Shorter, Elsevier, 1991, p. 455.
23. Ueberla K., Faktorenanalyse, Springer Verlag, 1977.
24. Trueblood K.N., Diffraction studies of molecular motion in crystals, chpt. 8 in Accurate Molecular Structures, Their Determination and Importance, Oxford University Press, 1992, p.199.
25. Binkley, J.S and Pople J.A., J. Am. Chem. Soc., 120, 939 (1980).