Information card for entry 7201962

Structure parameters

• Formula: C9 H12 Co N2 O5.5
• Calculated formula: C9 H9 Co N2 O4
• Title of publication: Design of two 3D homochiral Co(II) metal‒organic open frameworks by layered-pillar strategy: structure and properties
• Authors of publication: Zhu, Ping; Gu, Wen; Cheng, Fang-Yi; Liu, Xin; Chen, Jun; Yan, Shi-Ping; Liao, Dai-Zheng
• Journal of publication: CrystEngComm
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 8
• Pages of publication: 963
• a: 22.113 ± 0.003 Å
• b: 6.9149 ± 0.0012 Å
• c: 7.7209 ± 0.0014 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1180.6 ± 0.3 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0737
• Residual factor for significantly intense reflections: 0.07
• Weighted residual factors for significantly intense reflections: 0.1689
• Weighted residual factors for all reflections included in the refinement: 0.1716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No