Information card for entry 4112316

Structure parameters

• Common name: [Cu(2-pymo)2]n.[Li(H2O)4]n/3(NO3)n/3
• Formula: C24 H26 Cu3 Li N13 O13
• Calculated formula: C24 Cu3 Li N13 O12.98
• Title of publication: Mineralomimetic Sodalite- and Muscovite-Type Coordination Frameworks. Dynamic Crystal-to-Crystal Interconversion Processes Sensitive to Ion Pair Recognition
• Authors of publication: Elisa Barea; Jorge A. R. Navarro; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2004
• Journal volume: 126
• Pages of publication: 3014 - 3015
• a: 15.6475 ± 0.0005 Å
• b: 15.6475 ± 0.0005 Å
• c: 15.6475 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3831.2 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 224
• Hermann-Mauguin space group symbol: P n -3 m :2
• Hall space group symbol: -P 4bc 2bc 3
• Residual factor for all reflections: 0.0792
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.181
• Weighted residual factors for all reflections included in the refinement: 0.1939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No