Information card for entry 4121095

Structure parameters

• Common name: COF-320
• Formula: C53 H36 N4
• Calculated formula: C53 H36 N4
• Title of publication: Single-Crystal Structure of a Covalent Organic Framework
• Authors of publication: Yue-Biao Zhang; Jie Su; Hiroyasu Furukawa; Yifeng Yun; Felipe Gándara; Adam Duong; Xiaodong Zou; Omar M. Yaghi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 16336 - 16339
• a: 30.17 Å
• b: 30.17 Å
• c: 7.281 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6627.38 ų
• Cell temperature: 89 ± 2 K
• Ambient diffraction temperature: 89 ± 2 K
• Number of distinct elements: 3
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.3821
• Residual factor for significantly intense reflections: 0.31
• Weighted residual factors for significantly intense reflections: 0.6386
• Weighted residual factors for all reflections included in the refinement: 0.6677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 0.0251 Å
• Diffraction radiation type: Electrons
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No