Information card for entry 4346030

Structure parameters

• Formula: C10 H13 Cl Co N3 O4.5
• Calculated formula: C10 H13 Cl Co N3 O4.66
• Title of publication: Switching a 2D Co(II) layer to a 3D Co7-cluster-based metal-organic framework: syntheses, crystal structures, and magnetic properties.
• Authors of publication: Chen, Di-Ming; Ma, Xiao-Zhou; Zhang, Xue-Jing; Xu, Na; Cheng, Peng
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 2976 - 2982
• a: 17.687 ± 0.002 Å
• b: 7.2468 ± 0.0007 Å
• c: 11.5369 ± 0.001 Å
• α: 90°
• β: 108.467 ± 0.011°
• γ: 90°
• Cell volume: 1402.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0928
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1564
• Weighted residual factors for all reflections included in the refinement: 0.1744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No