Information card for entry 7231620

Structure parameters

• Formula: C32 H24 O2
• Calculated formula: C32 H24 O2
• Title of publication: Two-step photomechanical motion of a dibenzobarrelene crystal
• Authors of publication: Taniguchi, Takuya; Kubota, Ayumi; Moritoki, Tatsuya; Asahi, Toru; Koshima, Hideko
• Journal of publication: RSC Advances
• Year of publication: 2018
• Journal volume: 8
• Journal issue: 60
• Pages of publication: 34314
• a: 9.2639 ± 0.0003 Å
• b: 10.182 ± 0.0004 Å
• c: 14.3848 ± 0.0005 Å
• α: 102.884 ± 0.0019°
• β: 99.249 ± 0.002°
• γ: 112.004 ± 0.0019°
• Cell volume: 1180.7 ± 0.08 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0912
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.141
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No