Information card for entry 4510861

Structure parameters

• Formula: C21 H40 K2 N2 O12 Os
• Calculated formula: C21 H40 K2 N2 O12 Os
• Title of publication: Os(VI)O2/K Metal‒Organic Frameworks: Infinite Chain, Grid, and Porous Networks
• Authors of publication: Eckshtain-Levi, Meital; Yufit, Dmitry; Shimon, Linda J. W.; Kirillov, Alexander M.; Benisvy, Laurent
• Journal of publication: Crystal Growth & Design
• Year of publication: 2014
• Journal volume: 14
• Journal issue: 6
• Pages of publication: 2703
• a: 13.3502 ± 0.0002 Å
• b: 7.10564 ± 0.00011 Å
• c: 30.6426 ± 0.0004 Å
• α: 90°
• β: 100.306 ± 0.0015°
• γ: 90°
• Cell volume: 2859.91 ± 0.07 ų
• Cell temperature: 120 ± 0.2 K
• Ambient diffraction temperature: 120 ± 0.2 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: 0.0298
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0552
• Weighted residual factors for all reflections included in the refinement: 0.0567
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: Mo
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No