Information card for entry 7205840

Structure parameters

• Formula: C29 H29.26 Co N2 O7.63
• Calculated formula: C29 H29.258 Co N2 O7.629
• Title of publication: Structural variability of Co(ii) and Ni(ii) entangled metal‒organic frameworks: effect of N-donor ligands and metal ions
• Authors of publication: Liu, Jian-Qiang; Wang, Yao-Yu; Huang, Yun-Sheng
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 11
• Pages of publication: 3733
• a: 10.1829 ± 0.0015 Å
• b: 11.9666 ± 0.0018 Å
• c: 12.957 ± 0.002 Å
• α: 86.208 ± 0.002°
• β: 71.776 ± 0.002°
• γ: 64.945 ± 0.002°
• Cell volume: 1354.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0852
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1435
• Weighted residual factors for all reflections included in the refinement: 0.1832
• Goodness-of-fit parameter for all reflections included in the refinement: 0.951
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No