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Spectroscopic and Computational Assessment of the...
Journal article

Spectroscopic and Computational Assessment of the Rotational Barrier of a Ferrocenyl-Stabilized Cyclopentadienyl Cation: Evidence for the First Hydroxyfulvalene Ligand

Abstract

Protonation of 3-ferrocenyl-2,4,5-triphenylcyclopentadienone with trifluoroacetic acid results in the formation of the first hydroxyfulvalene complex. The dramatic deshielding and decoalescence of the 1H and 13C NMR signals in the ferrocenyl region offer evidence for the participation of the metal in the stabilization of the positive charge, which results in restricted rotation of the ferrocenyl group. As determined by NMR spectroscopy, the …

Authors

Harrington LE; Vargas-Baca I; Reginato N; McGlinchey MJ

Journal

Organometallics, Vol. 22, No. 4, pp. 663–669

Publisher

American Chemical Society (ACS)

Publication Date

February 1, 2003

DOI

10.1021/om020820f

ISSN

0276-7333