Information card for entry 2012991

Structure parameters

• Chemical name: 9-methylfluoren-9-ol
• Formula: C14 H12 O
• Calculated formula: C14 H12 O
• SMILES: OC1(c2ccccc2c2c1cccc2)C
• Title of publication: The low-temperature phase transition of 9-methylfluoren-9-ol: comparison of the crystal structures at 100 and 200K
• Authors of publication: Morris, David G.; Muir, Kenneth W.; Ryder, Karl S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 10
• Pages of publication: o615 - o618
• a: 9.254 ± 0.0002 Å
• b: 11.4154 ± 0.0004 Å
• c: 11.8476 ± 0.0004 Å
• α: 89.198 ± 0.001°
• β: 116.162 ± 0.001°
• γ: 107.108 ± 0.001°
• Cell volume: 1063.82 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 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 significantly intense reflections: 0.049
• Weighted residual factors for all reflections included in the refinement: 0.127
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No