Information card for entry 7104064

Structure parameters

• Formula: C46 H44 Cu2 O20
• Calculated formula: C46 H24 Cu2 O20
• Title of publication: Homochiral 3D open frameworks assembled from 1- and 2-D coordination polymers
• Authors of publication: Cui, Yong; Ngo, Helen L.; White, Peter S.; Lin, Wenbin
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 8
• Pages of publication: 994 - 995
• a: 10.92 ± 0.03 Å
• b: 14.03 ± 0.04 Å
• c: 19.96 ± 0.06 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3060 ± 16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 23
• Hermann-Mauguin space group symbol: I 2 2 2
• Hall space group symbol: I 2 2
• Residual factor for all reflections: 0.176
• Residual factor for significantly intense reflections: 0.1194
• Weighted residual factors for significantly intense reflections: 0.2626
• Weighted residual factors for all reflections included in the refinement: 0.2899
• Goodness-of-fit parameter for all reflections included in the refinement: 1.358
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No