Collect. Czech. Chem. Commun. 2002, 67, 314-324
https://doi.org/10.1135/cccc20020314

Theoretical Justification of the Different Stages of Transformation of 1(3,6)-Phenanthrena-4-(1,4)-benzenacyclohexaphane-2,5-diene to Coronene

Maria J. Rioseras-Garcia and Jose M. Hernando-Huelmo*

Departamento de Química Física, Universidad de Valladolid, 47005-Valladolid, Spain

References

1. Mitchell R. H., Boekelheide V.: J. Am. Chem. Soc. 1974, 96, 1547. <https://doi.org/10.1021/ja00812a045>
2. Hernando-Huelmo J. M., Rioseras-Garcia M. J.: J. Mol. Struct. (Theochem) 1992, 257, 279. <https://doi.org/10.1016/0166-1280(92)85045-M>
3. Mitchell R. H.: Isr. J. Chem. 1980, 20, 294. <https://doi.org/10.1002/ijch.198000087>
4. Mitchell R. H., Willians R. V., Mahadevan R., Dingle T. W.: J. Am. Chem. Soc. 1982, 104, 2560. <https://doi.org/10.1021/ja00373a038>
5. Mitchell R. H., Willians R. V., Mahadevan R., Lai Y.-H., Dingle T. W.: J. Am. Chem. Soc. 1982, 104, 2571. <https://doi.org/10.1021/ja00373a039>
6. Mitchell R. H., Carruthers R. J., Mazuch L., Dingle T. W.: J. Am. Chem. Soc. 1982, 104, 2544. <https://doi.org/10.1021/ja00373a036>
7. Baker W., McOmie J. F. W., Norman J. M.: J. Chem. Soc. 1951, 1114. <https://doi.org/10.1039/jr9510001114>
8. Elschenbroich C., Gerson F., Reiss J. A.: J. Am. Chem. Soc. 1977, 99, 60. <https://doi.org/10.1021/ja00443a013>
9. Boekelheide V.: Pure Appl. Chem. 1975, 44, 751. <https://doi.org/10.1351/pac197544040751>
10. Mitchell R. H., Khalifa N. A., Dingle T. W.: J. Am. Chem. Soc. 1991, 113, 6696. <https://doi.org/10.1021/ja00017a064>
11. Mitchell R. H., Boekelheide V.: J. Am. Chem. Soc. 1970, 92, 3510. <https://doi.org/10.1021/ja00714a071>
12. Cram D. J., Dewhirst K. C.: J. Am. Chem. Soc. 1959, 81, 5963. <https://doi.org/10.1021/ja01531a030>
13. Lawson J., DuVernet R., Boekelheide V.: J. Am. Chem. Soc. 1973, 95, 956. <https://doi.org/10.1021/ja00784a072>
14. Rioseras-Garcia M. J., Hernando-Huelmo J. M.: J. Mol. Struct. (Theochem) 1992, 262, 147. <https://doi.org/10.1016/0166-1280(92)85105-T>
15. Rioseras-Garcia M. J., Hernando-Huelmo J. M.: J. Org. Chem. 1994, 59, 2135. <https://doi.org/10.1021/jo00087a034>
16. Rioseras-Garcia M. J., Hernando-Huelmo J. M.: J. Mol. Struct. (Theochem) 1995, 337, 265. <https://doi.org/10.1016/0166-1280(94)04023-L>
17. Du Vernet R. B., Otsubo T., Lawsom J. A., Boekelheide V.: J. Am. Chem. Soc. 1975, 97, 1629. <https://doi.org/10.1021/ja00839a088>
18. Dewar M. J. S., Zoebisch E. G., Healy E. F., Stewart J. J. P.: J. Am. Chem. Soc. 1985, 107, 3902. <https://doi.org/10.1021/ja00299a024>
19. Stewart J. J.: Q.C.P.E. Program, No. 455. University of Indiana, Bloomington 1985.
20. Hernando-Huelmo J. M., Rioseras-Garcia M. J.: Theor. Chim. Acta 1993, 87, 233. <https://doi.org/10.1007/BF01112935>
21. Farnell L., Kao J., Radon L., Schaefer, III, H. F.: J. Am. Chem. Soc. 1981, 103, 2147. <https://doi.org/10.1021/ja00399a001>
22. Rioseras-Garcia M. J., Hernando-Huelmo J. M.: J. Mol. Struct. (Theochem) 1994, 315, 91. <https://doi.org/10.1016/0166-1280(94)03775-G>
23. Bregman J., Hirshfeld F. L., Rabinovich D., Schmidt G. M. J.: Acta Crystallogr. 1965, 19, 227. <https://doi.org/10.1107/S0365110X65003158>
24. Chiang C. C., Paul I. C.: J. Am. Chem. Soc. 1972, 94, 4741. <https://doi.org/10.1021/ja00768a058>
25. Hernando-Huelmo J. M., Quirante J. J., Enriquez F.: J. Mol. Struct. (Theochem) 1990, 204, 201. <https://doi.org/10.1016/0166-1280(90)85074-W>
26. Du Vernet R. B., Wennerströn O., Lawsom J., Otsubo T., Boekelheide V.: J. Am. Chem. Soc. 1978, 100, 2457. <https://doi.org/10.1021/ja00476a032>
27. Otsubo T., Gray R., Boekelheide V.: J. Am. Chem. Soc. 1978, 100, 2449. <https://doi.org/10.1021/ja00476a031>
28. Monteath-Robertson J., White J. G.: J. Chem. Soc. 1945, 607. <https://doi.org/10.1039/jr9450000607>