Information card for entry 7207788

Structure parameters

• Formula: C17 H17 Mn N O7
• Calculated formula: C17 H17 Mn N O7
• Title of publication: Metal‒organic frameworks based on naphthalene-1,5-diyldioxy-di-acetate: structures, topologies, photoluminescence and photocatalytic properties
• Authors of publication: Gong, Yun; Wu, Tao; Lin, JianHua
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 10
• Pages of publication: 3727
• a: 12.8267 ± 0.0003 Å
• b: 28.9972 ± 0.0008 Å
• c: 9.5316 ± 0.0003 Å
• α: 90°
• β: 92.186 ± 0.002°
• γ: 90°
• Cell volume: 3542.59 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0491
• Residual factor for significantly intense reflections: 0.0366
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.1042
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No