The effect of boron substitution on cyclacenes

Date

2001-01-15

Author

Türker, Burhan Lemi
Azizoglu, A

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AM1-type semiempirical molecular orbital treatment was performed on the Huckel-type cyclacenes having certain number of boron atoms at the peri-positions and at the fusion sites of the arenoid rings. The effect of boron atoms is generally destabilizing in all the cases as compared to their unsubstituted cyclacene counterparts. The AM1 results revealed that certain properties of the boron-substituted cyclacenes are affected not only by the number of arenoid rings they have but also by the nature of their peripheral circuits.

Subject Keywords

Substituted cyclacenes, AM1 calculations, Cyclacenes, Boron compounds, Boron

URI

https://hdl.handle.net/11511/62409

Journal

JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

DOI

https://doi.org/10.1016/s0166-1280(00)00589-3

Collections

Department of Chemistry, Article

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Citation Formats

B. L. Türker and A. Azizoglu, “The effect of boron substitution on cyclacenes,” JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, pp. 151–157, 2001, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/62409.