Information card for entry 4001075

Structure parameters

• Formula: C51 H30 Cu3 N3 O12
• Calculated formula: C51 H30 Cu3 N3 O12
• Title of publication: New Interpenetrated Copper Coordination Polymer Frameworks having Porous Properties
• Authors of publication: Kanoo, Prakash; Matsuda, Ryotaro; Higuchi, Masakazu; Kitagawa, Susumu; Maji, Tapas Kumar
• Journal of publication: Chemistry of Materials
• Year of publication: 2009
• Journal volume: 21
• Journal issue: 24
• Pages of publication: 5860
• a: 17.25 ± 0.01 Å
• b: 19.467 ± 0.009 Å
• c: 14.031 ± 0.012 Å
• α: 90°
• β: 95.22 ± 0.05°
• γ: 90°
• Cell volume: 4692 ± 5 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0507
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.0994
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No