Information card for entry 7115133

Structure parameters

• Formula: C115 H184 Ca4 Co4 N8 O85
• Calculated formula: C115 H104 Ca4 Co4 N8 O85
• Title of publication: Metal-promoted assembly of organic-based cages into a porous material
• Authors of publication: Harrison, Roger G.; Dalley, N. Kent; Nazarenko, Alex Y.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 15
• Pages of publication: 1387
• a: 18.598 ± 0.004 Å
• b: 27.575 ± 0.008 Å
• c: 37.106 ± 0.008 Å
• α: 90°
• β: 92.318 ± 0.01°
• γ: 90°
• Cell volume: 19014 ± 8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1352
• Residual factor for significantly intense reflections: 0.0889
• Weighted residual factors for all reflections: 0.3184
• Weighted residual factors for significantly intense reflections: 0.2501
• Goodness-of-fit parameter for all reflections: 1.055
• Goodness-of-fit parameter for significantly intense reflections: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No