Information card for entry 2011357

Structure parameters

• Chemical name: sp-9-Acetylfluorene
• Formula: C15 H12 O
• Calculated formula: C15 H12 O
• SMILES: O=C(C1c2c(c3ccccc13)cccc2)C
• Title of publication: <i>sp</i>-9-Acetylfluorene, the initial acetylation product of 9-fluorenyllithium
• Authors of publication: Meyers, Cal Y.; Lutfi, Hisham G.; Robinson, Paul D.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 9
• Pages of publication: e418 - e419
• a: 11.253 ± 0.004 Å
• b: 5.74 ± 0.006 Å
• c: 17.782 ± 0.006 Å
• α: 90°
• β: 98.19 ± 0.03°
• γ: 90°
• Cell volume: 1136.9 ± 1.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.134
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for all reflections included in the refinement: 0.156
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes