Information card for entry 7710165

Structure parameters

• Formula: C126 H97 Co12 N35 O22
• Calculated formula: C126 H93 Co12 N35 O22
• Title of publication: Supramolecular Isomorphic Dodecanuclear Cobalt Clusters with Same Metal Shell but Different Core Ligands
• Authors of publication: Liang, Xiao-Wen; Zhang, Lin-Lin; Zhang, Ting; Zhao, Jiong-Peng; liu, fuchen
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 17.0982 ± 0.0019 Å
• b: 17.2094 ± 0.0016 Å
• c: 27.081 ± 0.003 Å
• α: 101.09 ± 0.008°
• β: 96.192 ± 0.009°
• γ: 101.735 ± 0.009°
• Cell volume: 7566.2 ± 1.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.2204
• Residual factor for significantly intense reflections: 0.1029
• Weighted residual factors for significantly intense reflections: 0.2191
• Weighted residual factors for all reflections included in the refinement: 0.2959
• Goodness-of-fit parameter for all reflections included in the refinement: 0.929
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No