Information card for entry 7158913

Structure parameters

• Common name: cyclomer-1
• Chemical name: 1-tetramer
• Formula: C56 H32 O16
• Calculated formula: C56 H32 O16
• Title of publication: Porous Materials Formed by Four Self-construction Processes
• Authors of publication: Liu, Qiuhua; Shen, Xiaorong; Dai, Ye; Zhang, Mengchen; Zhou, Zaichun
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2022
• a: 18.435 ± 0.004 Å
• b: 7.4378 ± 0.0015 Å
• c: 19.155 ± 0.004 Å
• α: 90°
• β: 92.16 ± 0.03°
• γ: 90°
• Cell volume: 2624.6 ± 1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 3
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1147
• Residual factor for significantly intense reflections: 0.1063
• Weighted residual factors for significantly intense reflections: 0.352
• Weighted residual factors for all reflections included in the refinement: 0.3678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No