1,4-didecapentaene-substituted cyclacenes - AM1 treatment

2002-07-05
Türker, Burhan Lemi
Austin model I type semi-empirical calculations are performed to calculate various energies and to get some molecular orbital properties of the 1,4-didecapentaene-substituted cyclacenes having 3-8 benzenoid rings. The systems considered should be stable, endothermic and possibly have some non-linear properties.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM

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Citation Formats
B. L. Türker, “1,4-didecapentaene-substituted cyclacenes - AM1 treatment,” JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, pp. 19–23, 2002, Accessed: 00, 2020. [Online]. Available: https://hdl.handle.net/11511/62287.