Information card for entry 1561736

Structure parameters

• Formula: C20 H14 Mn N2 O6
• Calculated formula: C20 H14 Mn N2 O6
• Title of publication: Solvent induced synthesis, structure and properties of coordination polymers based on 5-hydroxyisophthalic acid as linker and 1,10-phenanthroline as auxiliary ligand
• Authors of publication: Kariem, Mukaddus; Yawer, Mohd; Sheikh, Haq Nawaz
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2015
• Journal volume: 231
• Pages of publication: 239 - 247
• a: 8.5807 ± 0.0003 Å
• b: 12.1887 ± 0.0005 Å
• c: 17.2541 ± 0.0007 Å
• α: 90°
• β: 100.885 ± 0.001°
• γ: 90°
• Cell volume: 1772.1 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0402
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0676
• Weighted residual factors for all reflections included in the refinement: 0.0752
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes