Information card for entry 4500073

Structure parameters

• Formula: C134.5 H128 N40 O7.5 S5
• Calculated formula: C134.5 H128 N40 O7.5 S5
• Title of publication: Molecular Tectonics. Porous Hydrogen-Bonded Networks Built from Derivatives of 2,2',7,7'-Tetraphenyl-9,9'-spirobi[9H-fluorene]
• Authors of publication: Eric Demers; Thierry Maris; James D. Wuest
• Journal of publication: Cryst. Growth & Design
• Year of publication: 2005
• Journal volume: 5
• Pages of publication: 1227 - 1235
• a: 12.2162 ± 0.001 Å
• b: 21.2975 ± 0.0017 Å
• c: 30.884 ± 0.002 Å
• α: 93.026 ± 0.003°
• β: 94.69 ± 0.004°
• γ: 96.419 ± 0.003°
• Cell volume: 7942.5 ± 1 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1295
• Residual factor for significantly intense reflections: 0.0929
• Weighted residual factors for significantly intense reflections: 0.2332
• Weighted residual factors for all reflections included in the refinement: 0.24
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No