Information card for entry 4119755

Structure parameters

• Formula: C60 H114 N18 O72 U6
• Calculated formula: C60 H114 N18 O72 U6
• Title of publication: Development of Metal-Organic Nanotubes Exhibiting Low-Temperature, Reversible Exchange of Confined "Ice Channels"
• Authors of publication: Daniel K. Unruh; Kyle Gojdas; Anna Libo; Tori Z. Forbes
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2013
• Journal volume: 135
• Pages of publication: 7398 - 7401
• a: 22.3054 ± 0.0013 Å
• b: 22.3054 ± 0.0013 Å
• c: 6.6297 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2856.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.0198
• Weighted residual factors for significantly intense reflections: 0.0562
• Weighted residual factors for all reflections included in the refinement: 0.0569
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No