Information card for entry 1546121

Structure parameters

• Formula: C130 H160.5 N24 O15.25
• Calculated formula: C130 H126 N24 O15.2498
• Title of publication: Chirality as a tool for function in porous organic cages.
• Authors of publication: Hasell, T.; Little, M. A.; Chong, S. Y.; Schmidtmann, M.; Briggs, M. E.; Santolini, V.; Jelfs, K. E.; Cooper, A. I.
• Journal of publication: Nanoscale
• Year of publication: 2017
• Journal volume: 9
• Journal issue: 20
• Pages of publication: 6783 - 6790
• a: 24.318 ± 0.002 Å
• b: 24.318 ± 0.002 Å
• c: 24.318 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14381 ± 2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 198
• Hermann-Mauguin space group symbol: P 21 3
• Hall space group symbol: P 2ac 2ab 3
• Residual factor for all reflections: 0.086
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.2033
• Weighted residual factors for all reflections included in the refinement: 0.2134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.6889 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No