Neutron Diffraction Refinement of the Structure of Pentaerythritol.

  • Semmingsen D
  • Møllendal H
  • Stølen S
  • et al.
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Abstract

Pentaerythritol is tetragonal, space group I.hivin.4, with a 6.079(3) and c 8.745(4) Å; dc = 1.399 for Z = 2. The final Rw = 0.042 for 1118 reflections. At. coordinates are given. The bond lengths and bond angles are given. The O...O and H...O bond lengths and O-H...O angle are 2.698(3), 1.790(4) Å, and 163.6(3)°, resp. The H bonds form closed quadrilaterals around the .hivin.4 axes. [on SciFinder(R)]

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Semmingsen, D., Møllendal, H., Stølen, S., Andresen, A. F., Boggs, J. E., Lehrich, F., … Trætteberg, M. (1988). Neutron Diffraction Refinement of the Structure of Pentaerythritol. Acta Chemica Scandinavica, 42a, 279–283. https://doi.org/10.3891/acta.chem.scand.42a-0279

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