Information card for entry 8107028

Structure parameters

• Formula: C24 H16 O
• Calculated formula: C24 H16 O
• Title of publication: Crystal structure of 2-(4-methylbenzoyl)pyrene, C24H16O
• Authors of publication: Ran, Zhang; Fang-Fang, Han; Li-Fang, Zhang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 3
• Pages of publication: 855 - 857
• a: 13.642 ± 0.003 Å
• b: 10.787 ± 0.002 Å
• c: 11.551 ± 0.002 Å
• α: 90°
• β: 110.73 ± 0.03°
• γ: 90°
• Cell volume: 1589.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0572
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for significantly intense reflections: 0.1424
• Weighted residual factors for all reflections included in the refinement: 0.1482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No