Information card for entry 2239272

Structure parameters

• Chemical name: 1,1',1'',1'''-(Oxydimethanetriyl)tetrakis(4-fluorobenzene)
• Formula: C26 H18 F4 O2
• Calculated formula: C26 H18 F4 O
• SMILES: Fc1ccc(cc1)C(c1ccc(cc1)F)OC(c1ccc(cc1)F)c1ccc(cc1)F
• Title of publication: 1,1',1'',1'''-(Oxydimethanetriyl)tetrakis(4-fluorobenzene)
• Authors of publication: Roopashree, K. R.; Kavitha, H. D.; Katagi, K. S.; Kotresh, O.; Devarajegowda, H. C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 4
• Pages of publication: o475
• a: 8.1754 ± 0.0002 Å
• b: 8.9536 ± 0.0002 Å
• c: 15.3193 ± 0.0004 Å
• α: 104.965 ± 0.002°
• β: 95.175 ± 0.002°
• γ: 107.354 ± 0.002°
• Cell volume: 1016.87 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0779
• Residual factor for significantly intense reflections: 0.0479
• Weighted residual factors for significantly intense reflections: 0.116
• Weighted residual factors for all reflections included in the refinement: 0.1324
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes