Information card for entry 7133246

Structure parameters

• Formula: C107 H98.1 N6 O18
• Calculated formula: C107 H98.056 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
• a: 14.4122 ± 0.0008 Å
• b: 21.9201 ± 0.0008 Å
• c: 22.0159 ± 0.0005 Å
• α: 60.357 ± 0.003°
• β: 83.564 ± 0.003°
• γ: 74.23 ± 0.004°
• Cell volume: 5815.3 ± 0.5 ų
• Cell temperature: 99.98 ± 0.11 K
• Ambient diffraction temperature: 99.98 ± 0.11 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: 0.1991
• Residual factor for significantly intense reflections: 0.149
• Weighted residual factors for significantly intense reflections: 0.3708
• Weighted residual factors for all reflections included in the refinement: 0.4088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.258
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No