Information card for entry 8102291

Structure parameters

• Chemical name: benzyl 2,3-di-O-acetyl-4,6-cyclo-4,6-dideoxy-b-D-galactopyranosyl-(1->4)-2,3,6-tri-O-acetyl-b-D-glucopyranoside
• Formula: C29 H36 O14
• Calculated formula: C29 H36 O14
• Title of publication: Crystal structure of benzyl 2,3-di-O-acetyl-4,6-cyclo-4,6-dideoxy-β-D-galactopyranosyl-(1-4)-2,3,6- tri-O-acetyl-β-D-glucopyranoside, C29H36O14
• Authors of publication: Wolfgang Frey; Robert Sardzik; Volker Jäger
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2008
• Journal volume: 223
• Journal issue: 3
• Pages of publication: 259
• a: 22.475 ± 0.005 Å
• b: 8.157 ± 0.002 Å
• c: 18.115 ± 0.003 Å
• α: 90°
• β: 97.738 ± 0.015°
• γ: 90°
• Cell volume: 3290.8 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0816
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1526
• Weighted residual factors for all reflections included in the refinement: 0.1662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No