Information card for entry 2209686

Structure parameters

• Chemical name: (Naphtho[2,1-<i>b</i>]furan-2-yl)(3-methyl-3-phenylcyclobutyl)methanone
• Formula: C24 H20 O2
• Calculated formula: C24 H20 O2
• SMILES: O=C(C1CC(c2ccccc2)(C)C1)c1oc2c(c1)c1ccccc1cc2
• Title of publication: (3-Methyl-3-phenylcyclobutyl)(naphtho[2,1-<i>b</i>]furan-2-yl)methanone
• Authors of publication: Arıcı, Cengiz; Kırılmış, Cumhur; Koca, Murat; W. Heinemann, Frank
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: o2783 - o2784
• a: 5.9316 ± 0.0004 Å
• b: 11.969 ± 0.001 Å
• c: 13.76 ± 0.001 Å
• α: 112.064 ± 0.005°
• β: 97.27 ± 0.006°
• γ: 96.165 ± 0.006°
• Cell volume: 885.23 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.0658
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes