Information card for entry 7250873

Structure parameters

• Formula: C144 H135 Co3 N12 O21
• Calculated formula: C117 H72 Co3 N3 O12
• Title of publication: Synergistic ligand–guest engineering for topological and functional control in cobalt(ii)-based metal–organic frameworks
• Authors of publication: Shi, Huatian; Liao, Yuluan; Li, Lianxiang; Sun, Po; wei, Xianwen; Yu, Weibin
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 42
• Pages of publication: 6894 - 6904
• a: 57.02 ± 0.03 Å
• b: 20.59 ± 0.008 Å
• c: 22.286 ± 0.013 Å
• α: 90°
• β: 108.37 ± 0.03°
• γ: 90°
• Cell volume: 24831 ± 2 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1946
• Residual factor for significantly intense reflections: 0.1384
• Weighted residual factors for significantly intense reflections: 0.2713
• Weighted residual factors for all reflections included in the refinement: 0.2967
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No