Information card for entry 7105223

Structure parameters

• Formula: C87 H108 F30 N16 O9
• Calculated formula: C87 H108 F30 N16 O9
• Title of publication: Efficient fixation of atmospheric CO2 as carbonate in a capsule of a neutral receptor and its release under mild conditions.
• Authors of publication: Ravikumar, I; Ghosh, Pradyut
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 7
• Pages of publication: 1082 - 1084
• a: 21.923 ± 0.003 Å
• b: 19.069 ± 0.003 Å
• c: 23.089 ± 0.003 Å
• α: 90°
• β: 95.027 ± 0.002°
• γ: 90°
• Cell volume: 9615 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0501
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.1062
• Weighted residual factors for all reflections included in the refinement: 0.1168
• Goodness-of-fit parameter for all reflections included in the refinement: 0.85
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No