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The molecular dynamics and reactivity of tris(inden-1-yl)silane : an NMR spectroscopic and X-ray crystallographic study

Abstract

The synthesis, structural characterisation (NMR, X-ray), molecular dynamics and reactivity of tris(inden-1-yl)silane, 9, are discussed. Spectroscopic data obtained from 2D-EXSY NMR experiments clearly demonstrate that the title compound is stereochemically non-rigid, even at temperatures where line broadening is not evident (ΔG‡ ≈ 24 kcal mol−1). The dynamic behaviour of 9 is rationalised in terms of successive [1,5]-silicon shifts; indeed, the isoindene intermediates generated in this process have been sequentially trapped by tetracyanoethylene, yielding tris(5,6-benzo-2,2,3,3-tetracyanobicyclo[2.2.1]hept-5-en-7-yl)silane,‡14. The silane, 9, has been transformed into tris(inden-1-yl)hexylsilane, 19, via hydrosilylation with hex-1-ene in the presence of Wilkinson’s catalyst. Compound 14 was quantitatively converted into the crystallographically characterised tris(5,6-benzo-2,2,3,3-tetracyanobicyclo[2.2.1]hept-5-en-7-yl)silanol, 17, by treatment with water, or into tris(5,6-benzo-2,2,3,3-tetracyanobicyclo[2.2.1]hept-5-en-7-yl)fluorosilane, 22, by the addition of either HBF4 or Ph3C+PF6−.

Authors

Stradiotto M; Brook MA; McGlinchey MJ

Journal

Journal of the Chemical Society, Perkin Transactions 2, Vol. 0, No. 4, pp. 611–618

Publisher

Royal Society of Chemistry (RSC)

Publication Date

January 1, 2000

DOI

10.1039/b000458h

ISSN

1472-779X
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