Information card for entry 1571596

Structure parameters

• Formula: C41 H30 N4 O
• Calculated formula: C41 H28 N4
• Title of publication: Analysis of COF-300 synthesis: probing degradation processes and 3D electron diffraction structure.
• Authors of publication: Bourda, Laurens; Bhandary, Subhrajyoti; Ito, Sho; Göb, Christian R; Van Der Voort, Pascal; Van Hecke, Kristof
• Journal of publication: IUCrJ
• Year of publication: 2024
• Journal volume: 11
• Journal issue: 4
• a: 20.7 ± 0.3 Å
• b: 20.7 ± 0.3 Å
• c: 8.8 ± 0.2 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3771 ± 12 ų
• Cell temperature: 298 ± 1 K
• Ambient diffraction temperature: 298 ± 1 K
• Number of distinct elements: 4
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.1808
• Residual factor for significantly intense reflections: 0.1372
• Weighted residual factors for significantly intense reflections: 0.3425
• Weighted residual factors for all reflections included in the refinement: 0.3793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.316
• Diffraction radiation probe: electron
• Diffraction radiation wavelength: 0.0251 Å
• Diffraction radiation type: transmissionelectronmicroscope
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No