Information card for entry 1559708

Structure parameters

• Formula: C19 H10 F6 O2
• Calculated formula: C19 H10 F6 O2
• Title of publication: Basic enemies of photochromism: irreversible transformation of fluorinated diarylethenes to polyenic enamines and enols.
• Authors of publication: Sysoiev, Dmytro; Huhn, Thomas
• Journal of publication: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
• Year of publication: 2020
• Journal volume: 19
• Journal issue: 11
• Pages of publication: 1511 - 1516
• a: 7.147 ± 0.001 Å
• b: 8.3925 ± 0.0012 Å
• c: 14.495 ± 0.002 Å
• α: 81.952 ± 0.012°
• β: 87.947 ± 0.012°
• γ: 78.899 ± 0.012°
• Cell volume: 844.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0882
• Weighted residual factors for all reflections included in the refinement: 0.0961
• Goodness-of-fit parameter for all reflections included in the refinement: 0.92
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No