Information card for entry 7107863

Structure parameters

• Formula: C22 H22 F6 I P
• Calculated formula: C22 H22 F6 I P
• Title of publication: Congested C2-symmetric aryliodanes based on an anti-dimethanoanthracene backbone
• Authors of publication: Stephen J. Murray; Helge Muller-Bunz; Hasim Ibrahim
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 6268
• a: 8.5505 ± 0.0002 Å
• b: 12.8539 ± 0.0002 Å
• c: 18.8604 ± 0.0004 Å
• α: 90°
• β: 93.496 ± 0.002°
• γ: 90°
• Cell volume: 2069.04 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0472
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.117
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No