Information card for entry 7237792

Structure parameters

• Formula: C44 H24 F10 O8
• Calculated formula: C44 H24 F10 O8
• Title of publication: Directed polymorphism and mechanofluorochromism of conjugated materials through weak non-covalent control
• Authors of publication: Sharber, Seth A.; Mann, Arielle; Shih, Kuo-Chih; Mullin, William J.; Nieh, Mu-Ping; Thomas, Samuel W.
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 27
• Pages of publication: 8316
• a: 7.5972 ± 0.0008 Å
• b: 13.9199 ± 0.0014 Å
• c: 18.3585 ± 0.0019 Å
• α: 100.489 ± 0.002°
• β: 91.139 ± 0.002°
• γ: 102.556 ± 0.002°
• Cell volume: 1859.8 ± 0.3 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: 0.0606
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.1347
• 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