Information card for entry 4126640

Structure parameters

• Formula: C27 H26.5 Cl2 F N O9.25
• Calculated formula: C27 H26.414 Cl2 F N O9.207
• Title of publication: Remarkable Reactivity Differences between Glucosides with Identical Leaving Groups.
• Authors of publication: Duo, Tianmeng; Robinson, Kyle; Greig, Ian R.; Chen, Hong-Ming; Patrick, Brian O.; Withers, Stephen G.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 21.556 ± 0.006 Å
• b: 6.8458 ± 0.0017 Å
• c: 21.251 ± 0.008 Å
• α: 90°
• β: 118.661 ± 0.005°
• γ: 90°
• Cell volume: 2751.7 ± 1.5 ų
• Cell temperature: 90 ± 0.1 K
• Ambient diffraction temperature: 90 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0355
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0732
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No