Information card for entry 4122763

Structure parameters

• Formula: C180 H234 Ag6 F42 N24 O12 P6 S6
• Calculated formula: C137.64 H137.76 Ag6 F41.9 N24 P6 S6
• Title of publication: Porous molecular crystals by macrocyclic coordination supramolecules.
• Authors of publication: Bassanetti, Irene; Comotti, Angiolina; Sozzani, Piero; Bracco, Silvia; Calestani, Gianluca; Mezzadri, Francesco; Marchiò, Luciano
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 42
• Pages of publication: 14883 - 14895
• a: 43.087 ± 0.002 Å
• b: 43.087 ± 0.002 Å
• c: 43.087 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 79991 ± 6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 203
• Hermann-Mauguin space group symbol: F d -3 :2
• Hall space group symbol: -F 2uv 2vw 3
• Residual factor for all reflections: 0.0955
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No