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Published on WebExtended Barbaralanes: Sigmatropic Shiftamers or σ-Polyacenes? Dean J. Tantillo,*,†,‡ Roald Hoffmann,† Kendall N. Houk,§ Philip M. Warner,⊥ Eric C. Brown,| and Daven K. Henze|
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Document Date: 2004-10-13 15:35:30


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Davis / Lund / Pittsburgh / New York / /

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Gaussian Inc. / Stephens / /

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Sweden / /

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Cornell UniVersity / UniVersity of Washington / Northeastern UniVersity / University of Lund / UniVersity of California / Å. terminal / /

IndustryTerm

zero-point energy corrections / rigid polycyclic systems / relative energy / chemical shift / model systems / constrained systems / energy calculations / energy differences / energy / been probed previously using nucleus-independent chemical shift / /

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University of California / We / National Science Foundation / University of California / Davis / Northeastern UniVersity / Boston / National Computational Science Alliance / UniVersity of California / Los Angeles / University of Lund / Department of Chemistry and Biochemistry / Department of Chemistry and Chemical Biology / UniVersity of Washington / Seattle / Department of Theoretical Chemistry / Mary M. Gates / Chemical Centre / Cornell UniVersity / Department of Chemistry / /

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Fox / Dean J. Tantillo / Eric C. Brown / Wes Borden / Kendall N. Houk / § Philip / /

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D. J. / Professor / A. D. J. / /

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Pennsylvania / California / /

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4260 J. AM / J. AM / 9 J. AM / 4262 J. AM / 4258 J. AM / /

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3G / /

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http /