Structural and electronic properties of AlP doped Hückel type cyclacene with four benzenoid rings

International Journal of Modern Physics C

Volumn 14, Issue 9, 2003, Pages 1183-1189

  Erkoç, Şakir ^a   Malcioǧlu, Osman Bariş ^a  

^a MIDDLE EAST TECHNICAL UNIVERSITY   (Turkey)

Author keywords

Aluminum; AM1 method; Cyclacene; Phosphorous; Semi empirical calculation

Indexed keywords

EID: 12144291506     PISSN: 01291831     EISSN: None     Source Type: Journal    
DOI: 10.1142/S0129183103005339     Document Type: Article

References (18)

1. S. Kivelson and O. L. Chapman, Phys. Rev. 28, 7236 (1983).
2. R. W. Alder and R. B. Sessions, J. Chem. Soc., Perkin Trans. 2, 1849 (1985).
3. J. L. Bergan, B. N. Cyvin, and S. J. Cyvin, Acta Chim. Hung. 124, 299 (1987).
4. P. R. Ashton, N. S. Isaacs, F. H. Kohnke, A. M. Z. Slawin, C. M. Spencer, J. F. Stoddart, and D. J. Williams, Angew. Chem. Int. Ed. Engl. 27, 966 (1988).
5. F. J. Zhang, S. J. Cyvin, and B. N. Cyvin, Monatch. Chem. 121, 421 (1990).
6. R. O. Angus, Jr. and R. P. Johnson, J. Org. Chem. 53, 314 (1988).
7. L. Türker, Polycyclic Aromatic Compounds 8, 67 (1996).
8. I. Gutman, P. U. Biederman, V. I. Petrovic, and I. Agranat, Polycyclic Aromatic Compounds 8, 189 (1996).
9. L. Türker, J. Molecular Structure (Theochem.) 454, 83 (1998).
10. H. S. Choi and K. S. Kim, Angew. Chem. Int. Ed. 38(15), 2256 (1999).
11. R. M. Gory and C. L. McPhail, Tetrahedron Lett. 37, 1987 (1996).
12. L. Türker and Ş. Erkoç, J. Molecular Structure (Theochem.) 578, 65 (2002).
13. L. Türker and Ş. Erkoç, J. Molecular Structure (Theochem.) 531, 401 (2000).
14. L. Türker and Ş. Erkoç, submitted for publication.
15. M. J. S. Dewar, E. G. Zoebisch, E. F. Healey, and J. J. P. Stewart, J. Am. Chem. Soc. 107, 3902 (1985).
16. A. R. Leach, Molecular Modelling (Longman, Essex, 1997).
17. Hypercube, Inc., Gainesville, FL, USA.
18. M. J. S. Dewar and R. C. Dougherty, PMO Theory of Organic Chemistry (Plenum-Rosetta, New York, 1975).