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Molecular structure and absolute configuration of (−)-(1R, 2S, 6R, 7S, 2′S)-5-(2′-hydroxymethylpyrrolidin-1′-yl)-endo-tricyclo[5.2.1.02,6]deca-4,8-dien-3-one

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Abstract

The crystal and molecular structure of (−)-(1R, 2S, 6R, 7S, 2′S)-5-(2′-hydroxymethyl-pyrrolidin-1′-yl)-endo-tricyclo[5.2.1.02,6]deca-4,8-dien-3-one is described. Knowing the absolute configuration of the prolinol moiety (S) the X-ray diffraction study established the absolute configuration of the title compound. The structure was refined to R 1 = 0.0322 for 1237 reflections (with I > 2σ(I)). Crystal data: C15H19NO2, monoclinic, space group P21, a = 6.0757(4), b = 11.3473(5), c = 9.5114(7)Å, β = 104.686(6)°, V = 634.32(7)Å3, and Z = 2.

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Authors and Affiliations

  1. Department of Inorganic Chemistry, Nijmegen SON Research Center, University of Nijmegen, Toernooiveld 1, 6525 ED, Nijmegen, The Netherlands

    René de Gelder & Jan M. M. Smits

  2. Department of Organic Chemistry, Nijmegen SON Research Center, University of Nijmegen, Toernooiveld 1, 6525 ED, Nijmegen, The Netherlands

    Namakkal G. Ramesh, Frank J. A. D. Bakkeren & Antonius J. H. Klunder

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  1. René de Gelder
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  2. Jan M. M. Smits
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  3. Namakkal G. Ramesh
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  4. Frank J. A. D. Bakkeren
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  5. Antonius J. H. Klunder
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de Gelder, R., Smits, J.M.M., Ramesh, N.G. et al. Molecular structure and absolute configuration of (−)-(1R, 2S, 6R, 7S, 2′S)-5-(2′-hydroxymethylpyrrolidin-1′-yl)-endo-tricyclo[5.2.1.02,6]deca-4,8-dien-3-one. Journal of Chemical Crystallography 28, 493–495 (1998). https://doi.org/10.1023/A:1021781024782

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