Information card for entry 7703628

Structure parameters

• Formula: C56 H42 Co2 N6 O11
• Calculated formula: C50 H33 Co2 N3 O11
• Title of publication: Exchange coupled Co(ii) based layered and porous metal-organic frameworks: structural diversity, gas adsorption, and magnetic properties.
• Authors of publication: Kharwar, Ajit Kumar; Konar, Sanjit
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 13
• Pages of publication: 4012 - 4021
• a: 15.2801 ± 0.0011 Å
• b: 23.978 ± 0.0017 Å
• c: 28.247 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10349.3 ± 1.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 73
• Hermann-Mauguin space group symbol: I b c a
• Hall space group symbol: -I 2b 2c
• Residual factor for all reflections: 0.1236
• Residual factor for significantly intense reflections: 0.0836
• Weighted residual factors for significantly intense reflections: 0.2091
• Weighted residual factors for all reflections included in the refinement: 0.2314
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No