Information card for entry 1505114

Structure parameters

• Formula: C18 H6 F10
• Calculated formula: C18 H6 F10
• SMILES: Fc1c(/C=C/C=C/C=C/c2c(F)c(F)c(c(c2F)F)F)c(F)c(c(c1F)F)F
• Title of publication: Fluorinated diphenylpolyenes: crystal structures and emission properties.
• Authors of publication: Sonoda, Yoriko; Goto, Midori; Tsuzuki, Seiji; Tamaoki, Nobuyuki
• Journal of publication: The journal of physical chemistry. A
• Year of publication: 2007
• Journal volume: 111
• Journal issue: 51
• Pages of publication: 13441 - 13451
• a: 5.9392 ± 0.0013 Å
• b: 8.1021 ± 0.0018 Å
• c: 8.5594 ± 0.0019 Å
• α: 80.335 ± 0.003°
• β: 78.54 ± 0.004°
• γ: 73.542 ± 0.004°
• Cell volume: 384.39 ± 0.15 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 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 all reflections: 0.0462
• Residual factor for significantly intense reflections: 0.0422
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1492
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No