Information card for entry 7227647

Structure parameters

• Formula: C24 H14 F12
• Calculated formula: C24 H14 F12
• SMILES: FC(F)(F)c1c(c2c3c(c1)c(cc(c3c1c(c(c(c(c21)C)C(F)(F)F)C(F)(F)F)C)C)C(F)(F)F)C
• Title of publication: Solid state structures of fluorine-rich fluoranthenes
• Authors of publication: Schmidt, Bernd M.; Meyer, Annika K.; Lentz, Dieter
• Journal of publication: CrystEngComm
• Year of publication: 2017
• Journal volume: 19
• Journal issue: 9
• Pages of publication: 1328
• a: 11.817 ± 0.003 Å
• b: 21.237 ± 0.004 Å
• c: 8.258 ± 0.0016 Å
• α: 90°
• β: 97.474 ± 0.002°
• γ: 90°
• Cell volume: 2054.8 ± 0.8 ų
• Cell temperature: 153 K
• Ambient diffraction temperature: 153 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 significantly intense reflections: 0.0504
• Weighted residual factors for all reflections included in the refinement: 0.0599
• Goodness-of-fit parameter for all reflections included in the refinement: 3.246
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No