Information card for entry 1573317

Structure parameters

• Formula: C20 H22 Mn2 N2 O8
• Calculated formula: C20 H22 Mn2 N2 O8
• Title of publication: Metal-organic frameworks of <i>p</i>-hydroxybenzoic acid: synthesis, structure and ring opening polymerization capability.
• Authors of publication: Gong, Yi; Sharp, Simon J.; Elsegood, Mark R. J.; Redshaw, Carl
• Journal of publication: RSC advances
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 51
• Pages of publication: 37895 - 37901
• a: 16.6962 ± 0.0005 Å
• b: 13.0537 ± 0.0004 Å
• c: 19.1273 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4168.7 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0785
• Residual factor for significantly intense reflections: 0.0581
• Weighted residual factors for significantly intense reflections: 0.1567
• Weighted residual factors for all reflections included in the refinement: 0.1718
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No