Investigation of HMO spectra of Huckel and Mobius type cyclacenes

Date

1997-01-01

Author

Turker, L
Erkoç, Şakir

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The Huckel molecular orbital spectra (HMO) of Huckel- and Mobius-type cyclacenes having 3-15 benzenoid rings were investigated and it was found that certain eigenvalues are topologically invariant, whereas others exhibit topological periodicity. Fbr example, Huckel-type cyclacenes having 2r (r: 2,3,4,...) benzenoid rings which possess nonbonding molecular orbitals (NBMO) and are thus expected to be open shell structures.

Subject Keywords

MOLECULAR GRAPHS, EIGENVALUES, SYMMETRY

URI

https://hdl.handle.net/11511/53293

Journal

TURKISH JOURNAL OF CHEMISTRY

Collections

Department of Physics, Article

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Citation Formats

L. Turker and Ş. Erkoç, “Investigation of HMO spectra of Huckel and Mobius type cyclacenes,” TURKISH JOURNAL OF CHEMISTRY, pp. 167–172, 1997, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/53293.