MATRIX-ISOLATION OF 3,4-BENZOCYCLODECA-3,7,9-TRIENE-1,5-DIYNE

Authors
KOTTING C SANDER W KAMMERMEIER S HERGES R
Citation
C. Kotting et al., MATRIX-ISOLATION OF 3,4-BENZOCYCLODECA-3,7,9-TRIENE-1,5-DIYNE, EUROPEAN JOURNAL OF ORGANIC CHEMISTRY, (5), 1998, pp. 799-803
Citations number
22
Categorie Soggetti
Chemistry Inorganic & Nuclear
Journal title
EUROPEAN JOURNAL OF ORGANIC CHEMISTRY → ACNP
ISSN journal
1434193X
Issue
5
Year of publication
1998
Pages
799 - 803
Database
ISI
SICI code
1434-193X(1998):5<799:MO3>2.0.ZU;2-Q
Abstract
3,4-Benzocyclodeca-3,7,9-triene-1,5-diyne (3) has been synthesized fro m two different precursors and characterized by means of matrix-isolat ion spectroscopy. Energies, structures and IR spectra of the product, the intermediate 9,10-didehydroanthracene (4), and of the transition s tate of the Bergman cyclization 3 --> 4 have been calculated at the B3 LYP/6-31G level of theory.