Information card for entry 7106880

Structure parameters

• Formula: C24 H8 Cl Cu4 O16
• Calculated formula: C24 H8 Cl Cu4 O16
• Title of publication: Pore partition effect on gas sorption properties of an anionic metal-organic framework with exposed Cu2+ coordination sites
• Authors of publication: Yan-Xi Tan; Yan-Ping He; Jian Zhang
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 10647
• a: 15.384 ± 0.0011 Å
• b: 15.384 ± 0.0011 Å
• c: 15.384 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3640.9 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 221
• Hermann-Mauguin space group symbol: P m -3 m
• Hall space group symbol: -P 4 2 3
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.2285
• Weighted residual factors for all reflections included in the refinement: 0.2307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.154
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No