Information card for entry 2004961

Structure parameters

• Chemical name: p-nitrophenyl-α-D-mannopyranoside hemihydrate
• Formula: C24 H32 N2 O17
• Calculated formula: C24 H32 N2 O17
• Title of publication: <i>p</i>-Nitrophenyl α-<small>D</small>-Mannopyranoside Hemihydrate
• Authors of publication: Fernandez-Castaño, C.; Foces-Foces, C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 6
• Pages of publication: 1586 - 1588
• a: 17.797 ± 0.003 Å
• b: 10.2594 ± 0.0006 Å
• c: 7.4438 ± 0.0005 Å
• α: 90°
• β: 98.44 ± 0.01°
• γ: 90°
• Cell volume: 1344.4 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.069
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for all reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.069
• Goodness-of-fit parameter for all reflections: 1.017
• Goodness-of-fit parameter for significantly intense reflections: 1.017
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No