Information card for entry 2016158

Structure parameters

• Chemical name: 1-deoxy-1-morpholino-D-fructopyranose
• Formula: C10 H19 N O6
• Calculated formula: C10 H19 N O6
• SMILES: C(N1CCOCC1)[C@]1(OC[C@@H](O)[C@@H](O)[C@@H]1O)O
• Title of publication: Hydrogen-bonded sheets of <i>R</i>~2~^2^(10) and <i>R</i>~4~^4^(24) rings in 1-deoxy-1-morpholino-<small>D</small>-fructopyranose
• Authors of publication: Rodríguez, Ricaurte; Cobo, Justo; Nogueras, Manuel; Low, John N.; Glidewell, Christopher
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 9
• Pages of publication: o507 - o509
• a: 5.2767 ± 0.0008 Å
• b: 5.5375 ± 0.0005 Å
• c: 10.2809 ± 0.0013 Å
• α: 104.598 ± 0.01°
• β: 90.393 ± 0.012°
• γ: 104.834 ± 0.01°
• Cell volume: 280.2 ± 0.06 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0373
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes