Information card for entry 7133245

Structure parameters

• Formula: C102 H90 N6 O18
• Calculated formula: C102 H90 N6 O18
• Title of publication: Porous organic crystals crosslinked by free-radical reactions.
• Authors of publication: Samanta, Krishanu; Mi, Jiashan; Chen, Albert D.; Li, Fangzhou; Staples, Richard J.; Rossini, Aaron J.; Ke, Chenfeng
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2024
• Journal volume: 60
• Journal issue: 57
• Pages of publication: 7311 - 7314
• a: 14.3348 ± 0.0002 Å
• b: 21.7619 ± 0.0003 Å
• c: 21.9674 ± 0.0003 Å
• α: 114.642 ± 0.001°
• β: 97.609 ± 0.001°
• γ: 108.079 ± 0.001°
• Cell volume: 5642.86 ± 0.16 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1003
• Residual factor for significantly intense reflections: 0.0937
• Weighted residual factors for significantly intense reflections: 0.27
• Weighted residual factors for all reflections included in the refinement: 0.2749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No