Information card for entry 7114644

Structure parameters

• Formula: C36 H48 Ag8 Ni2 O31 S12
• Calculated formula: C36 H48 Ag7.98 Ni2 O31 S12
• Title of publication: Truncated trigonal prismatic tubular crystals consisting of a zeolite L-mimic metal-organic framework
• Authors of publication: Tae Hwan Noh; Jaeseong Jang; Woosik Hong; Haeri Lee; Ok-Sang Jung
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 7451
• a: 15.8928 ± 0.0003 Å
• b: 15.8928 ± 0.0003 Å
• c: 7.9116 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1730.6 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 147
• Hermann-Mauguin space group symbol: P -3
• Hall space group symbol: -P 3
• Residual factor for all reflections: 0.105
• Residual factor for significantly intense reflections: 0.0715
• Weighted residual factors for significantly intense reflections: 0.2221
• Weighted residual factors for all reflections included in the refinement: 0.2386
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No