Journal article

Publication year: 2009

Pages: 246-250

Journal: Theoretical and Experimental Chemistry

Volume number: 45

Issue number: 4

DOI Link: https://doi.org/10.1007/s11237-009-9089-2

Publisher: Springer

Abstract: 

The competition between positions C¹ and C³ in
homoadamantane upon oxidation was studied both theoretically and
experimentally. B3PW91 and MP2 calculations in the 6-31+G* basis were
used to study the structure of the homoadamantane radical-cation and its
complexes with acetonitrile. The reaction was found to proceed
predominantly at the homoadamantane C¹ position in the reaction with photoexcited 1,2,4,5-tetracyanobenzene.

Harvard Citation style: Gunchenko, P., Makukhina, A., Novikovskii, A., Yurchenko, A., Serafin, M., Schreiner, P., et al. (2009) Structure and transformations of the homoadamantane radical-cation, Theoretical and Experimental Chemistry, 45(4), pp. 246-250. https://doi.org/10.1007/s11237-009-9089-2

APA Citation style: Gunchenko, P., Makukhina, A., Novikovskii, A., Yurchenko, A., Serafin, M., Schreiner, P., & Fokin, A. (2009). Structure and transformations of the homoadamantane radical-cation. Theoretical and Experimental Chemistry. 45(4), 246-250. https://doi.org/10.1007/s11237-009-9089-2