Information card for entry 7234293

Structure parameters

• Formula: C81 H81 N3
• Calculated formula: C81 H81 N3
• Title of publication: [3+3] Imine and beta-ketoenamine tethered fluorescent covalent-organic frameworks for CO2 uptake and nitroaromatic sensing
• Authors of publication: D. Kaleeswaran; Pratap Vishnoi; Ramaswamy Murugavel
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2015
• Journal volume: 3
• Pages of publication: 7159 - 7171
• a: 9.392 ± 0.004 Å
• b: 25.613 ± 0.013 Å
• c: 32.908 ± 0.016 Å
• α: 90°
• β: 97.358 ± 0.001°
• γ: 90°
• Cell volume: 7851 ± 6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.12
• Residual factor for significantly intense reflections: 0.089
• Weighted residual factors for significantly intense reflections: 0.2247
• Weighted residual factors for all reflections included in the refinement: 0.2476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No