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Structural reassignment of obtusallenes V, VI, and VII by GIAO-based density functional prediction
D Christopher Braddock1, Henry S Rzepa
1Department of Chemistry, Imperial College London, London, UK.
Abstract:
Revised structures proposed previously for obtusallenes V-VII ( 5- 7) have been confirmed on the basis of computed GIAO-DFT 13C NMR chemical shifts.
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