Information card for entry 7040400

Structure parameters

• Formula: C28 H25 Co N2 O8 S
• Calculated formula: C28 H25 Co N2 O8 S
• Title of publication: Diverse structures of metal-organic frameworks via a side chain adjustment: interpenetration and gas adsorption.
• Authors of publication: Shen, Kang; Qin, Ling; Zheng, He-Gen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 41
• Pages of publication: 16205 - 16210
• a: 9.8308 ± 0.0013 Å
• b: 13.1731 ± 0.0017 Å
• c: 13.3024 ± 0.0017 Å
• α: 76.88 ± 0.002°
• β: 85.184 ± 0.002°
• γ: 89.477 ± 0.002°
• Cell volume: 1671.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.1494
• Weighted residual factors for all reflections included in the refinement: 0.1568
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No