Information card for entry 7206781

Structure parameters

• Formula: C12 H10 Co N4 O4
• Calculated formula: C12 H10 Co N4 O4
• Title of publication: Experimental and computational approach of understanding the gas adsorption in amino functionalized interpenetrated metal organic frameworks (MOFs)
• Authors of publication: Pachfule, Pradip; Chen, Yifei; Jiang, Jianwen; Banerjee, Rahul
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2011
• Journal volume: 21
• Journal issue: 44
• Pages of publication: 17737
• a: 12.819 ± 0.002 Å
• b: 23.058 ± 0.004 Å
• c: 23.654 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6992 ± 2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 70
• Hermann-Mauguin space group symbol: F d d d :2
• Hall space group symbol: -F 2uv 2vw
• Residual factor for all reflections: 0.0437
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.1087
• Weighted residual factors for all reflections included in the refinement: 0.1108
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No