Information card for entry 1513637

Structure parameters

• Formula: C48 H78 Co2 Li2 O12
• Calculated formula: C48 H78 Co2 Li2 O12
• Title of publication: Changing the bridging connectivity pattern within a heterometallic assembly: design of single-source precursors with discrete molecular structures
• Authors of publication: Wei, Zheng; Han, Haixiang; Filatov, Alexander S.; Dikarev, Evgeny V.
• Journal of publication: Chemical Science
• Year of publication: 2014
• Journal volume: 5
• Journal issue: 2
• Pages of publication: 813
• a: 12.815 ± 0.004 Å
• b: 9.767 ± 0.003 Å
• c: 21.674 ± 0.007 Å
• α: 90°
• β: 90.183 ± 0.004°
• γ: 90°
• Cell volume: 2712.8 ± 1.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.1173
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1356
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No