Information card for entry 4308364

Structure parameters

• Common name: MOF-502
• Formula: C25 H29 Co2 N3 O13
• Calculated formula: C25 H29 Co2 N3 O13
• Title of publication: Transformation of a Metal‒Organic Framework from the NbO to PtS Net
• Authors of publication: Chen, Banglin; Ockwig, Nathan W.; Fronczek, Frank R.; Contreras, Damacio S.; Yaghi, Omar M.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 2
• Pages of publication: 181 - 183
• a: 14.279 ± 0.003 Å
• b: 13.006 ± 0.002 Å
• c: 17.515 ± 0.003 Å
• α: 90°
• β: 96.872 ± 0.004°
• γ: 90°
• Cell volume: 3229.4 ± 1 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0854
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1291
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4300891
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No