Information card for entry 7200710

Structure parameters

• Formula: C26 H21 Cu N2 O12.5 Zn
• Calculated formula: C26 H20 Cu N2 O12.5 Zn
• Title of publication: Structural and chemical complexity in multicomponent inorganic‒organic framework materials
• Authors of publication: Feller, Russell K.; Cheetham, Anthony K.
• Journal of publication: CrystEngComm
• Year of publication: 2009
• Journal volume: 11
• Journal issue: 6
• Pages of publication: 980
• a: 9.678 ± 0.0012 Å
• b: 11.9246 ± 0.0016 Å
• c: 22.738 ± 0.003 Å
• α: 90°
• β: 95.508 ± 0.004°
• γ: 90°
• Cell volume: 2612 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.1284
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.0998
• Weighted residual factors for all reflections included in the refinement: 0.1161
• Goodness-of-fit parameter for all reflections included in the refinement: 0.812
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No