Information card for entry 2200963

Structure parameters

• Common name: (9,10-triptyceno)benzo-28-crown-8
• Formula: C40 H44 O8
• Calculated formula: C40 H44 O8
• Title of publication: (9,10-Triptyceno)benzo-28-crown-8
• Authors of publication: Jeffrey C. Bryan; Andrei A. Gakh; Richard A. Sachleben
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 2
• Pages of publication: o129 - o131
• a: 9.3198 ± 0.0017 Å
• b: 23.416 ± 0.002 Å
• c: 15.838 ± 0.003 Å
• α: 90°
• β: 91.333 ± 0.009°
• γ: 90°
• Cell volume: 3455.4 ± 1 ų
• Cell temperature: 233 K
• Ambient diffraction temperature: 233 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.129
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.111
• Weighted residual factors for all reflections included in the refinement: 0.134
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes