Information card for entry 4110125

Structure parameters

• Formula: C29.3 H29.6 B Cl0.286 F2 N2 O7.78
• Calculated formula: C29.2857 H29.5714 B Cl0.285714 F2 N2 O8.20571
• Title of publication: Aryl-Substituted C3-Bridged Oligopyrroles as Anion Receptors for Formation of Supramolecular Organogels
• Authors of publication: Hiromitsu Maeda; Yohei Haketa; Takashi Nakanishi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2007
• Journal volume: 129
• Pages of publication: 13661 - 13674
• a: 19.008 ± 0.003 Å
• b: 19.009 ± 0.004 Å
• c: 28.644 ± 0.005 Å
• α: 108.952 ± 0.007°
• β: 91.954 ± 0.006°
• γ: 96.686 ± 0.006°
• Cell volume: 9694 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2363
• Residual factor for significantly intense reflections: 0.1019
• Weighted residual factors for significantly intense reflections: 0.2457
• Weighted residual factors for all reflections included in the refinement: 0.3422
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No