Information card for entry 7058327

Structure parameters

• Formula: C16 H14 F4 O2
• Calculated formula: C16 H14 F4 O2
• Title of publication: Charge transfer complexes as colour changing and disappearing‒reappearing colour materials
• Authors of publication: Sharada, Durgam; Saha, Arijit; Saha, Binoy K.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 20
• Pages of publication: 7562
• a: 6.6907 ± 0.0006 Å
• b: 6.9985 ± 0.0007 Å
• c: 8.7933 ± 0.0008 Å
• α: 110.856 ± 0.009°
• β: 105.889 ± 0.008°
• γ: 96.533 ± 0.008°
• Cell volume: 359.7 ± 0.07 ų
• Cell temperature: 262 ± 2 K
• Ambient diffraction temperature: 262 ± 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: 0.0586
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No