Information card for entry 7104713

Structure parameters

• Formula: C49 H66 N8 O12
• Calculated formula: C49 H66 N8 O12
• Title of publication: Recognition and complexation of hydrated fluoride anion: F2(H2O)(6)(2-) templated formation of a dimeric capsule of a tripodal amide.
• Authors of publication: Arunachalam, M; Ghosh, Pradyut
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2009
• Journal volume: 34
• Journal issue: 36
• Pages of publication: 5389 - 5391
• a: 12.922 ± 0.006 Å
• b: 14.152 ± 0.007 Å
• c: 15.351 ± 0.007 Å
• α: 116.614 ± 0.006°
• β: 92.811 ± 0.007°
• γ: 101.864 ± 0.007°
• Cell volume: 2424 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1287
• Residual factor for significantly intense reflections: 0.0732
• Weighted residual factors for significantly intense reflections: 0.1747
• Weighted residual factors for all reflections included in the refinement: 0.2086
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No