Information card for entry 4024265

Structure parameters

• Formula: C25.64 H10.64 F6 O P S2
• Calculated formula: C25.64 H10.64 F6 O P S2
• Title of publication: 2,7-Substituted Hexafluoroheterofluorenes as Potential Building Blocks for Electron Transporting Materials
• Authors of publication: Katharine Geramita; Jennifer McBee; T. Don Tilley
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2009
• Journal volume: 74
• Pages of publication: 820 - 829
• a: 7.5554 ± 0.0012 Å
• b: 10.6761 ± 0.0018 Å
• c: 15.488 ± 0.003 Å
• α: 108.257 ± 0.003°
• β: 94.493 ± 0.003°
• γ: 107.582 ± 0.003°
• Cell volume: 1110.2 ± 0.3 ų
• Cell temperature: 167 ± 2 K
• Ambient diffraction temperature: 167 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.073
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.0935
• Weighted residual factors for all reflections included in the refinement: 0.0985
• Goodness-of-fit parameter for all reflections included in the refinement: 0.866
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No