Information card for entry 7200711

Structure parameters

• Formula: C38 H28 Cu2 N4 O16 Zn2
• Calculated formula: C38 H28 Cu2 N4 O16 Zn2
• 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: 10.871 ± 0.004 Å
• b: 16.511 ± 0.006 Å
• c: 11.097 ± 0.004 Å
• α: 90°
• β: 114.311 ± 0.009°
• γ: 90°
• Cell volume: 1815.2 ± 1.2 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.282
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1288
• Weighted residual factors for all reflections included in the refinement: 0.1747
• Goodness-of-fit parameter for all reflections included in the refinement: 0.722
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No