Information card for entry 7056179

Structure parameters

• Formula: C31 H23 P
• Calculated formula: C31 H23 P
• SMILES: P(=C1c2ccccc2c2ccccc12)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Polymorphism and benzene solvent controlled stimuli responsive reversible fluorescence switching in triphenylphosphoniumfluorenylide crystals
• Authors of publication: Hariharan, P. S.; Mariyatra, M. Baby; Mothi, E. M.; Neels, Antonia; Rosair, Georgina; Anthony, Savarimuthu Philip
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 11
• Pages of publication: 4592 - 4598
• a: 13.252 ± 0.003 Å
• b: 16.668 ± 0.002 Å
• c: 10.2556 ± 0.0018 Å
• α: 90°
• β: 103.378 ± 0.014°
• γ: 90°
• Cell volume: 2203.8 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0533
• Residual factor for significantly intense reflections: 0.0454
• Weighted residual factors for significantly intense reflections: 0.1205
• Weighted residual factors for all reflections included in the refinement: 0.1284
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No