Information card for entry 3000067

Structure parameters

• Common name: α-D-mannose
• Chemical name: α-D-mannopyranose
• Formula: C6 H12 O6
• Authors of publication: Patyk-Kazmierczak, E.; Warren, M.; Allan, D.; Andrzej Katrusiak
• Journal of publication: To be published
• a: 21.9 ± 0.03 Å
• b: 8.9676 ± 0.0011 Å
• c: 6.6585 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1307.7 ± 1.8 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Ambient diffracton pressure: 4000000 kPa
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0869
• Residual factor for significantly intense reflections: 0.064
• Weighted residual factors for significantly intense reflections: 0.1397
• Weighted residual factors for all reflections included in the refinement: 0.1501
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No