Information card for entry 2012076

Structure parameters

• Common name: lactosyl acetamide
• Chemical name: β-1-N-Acetamido-(4-O-β-D-galactopyranosyl)-D-glucopyranose dihydrate
• Formula: C14 H29 N O13
• Calculated formula: C14 H29 N O13
• Title of publication: β-1-Acetamido-4-<i>O</i>-β-<small>D</small>-galactopyranosyl-<small>D</small>-glucopyranose dihydrate
• Authors of publication: Lakshmanan, Thiruneelakantan; Sriram, Desikan; Loganathan, Duraikannu
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 7
• Pages of publication: 825 - 826
• a: 4.86 ± 0.006 Å
• b: 7.603 ± 0.01 Å
• c: 13.242 ± 0.002 Å
• α: 85.47 ± 0.01°
• β: 84.06 ± 0.02°
• γ: 75.19 ± 0.01°
• Cell volume: 469.8 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0282
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for all reflections included in the refinement: 0.0719
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No