Information card for entry 2020491

Structure parameters

• Chemical name: Bis(2-aminopyridinium) tris[hexaaquamagnesium(II)] tetrakis(sulfate) dihydrate
• Formula: C10 H54 Mg3 N4 O36 S4
• Calculated formula: C10 H54 Mg3 N4 O36 S4
• Title of publication: Synthesis, structure and characterization of five new organically templated metal sulfates with 2-aminopyridinium
• Authors of publication: Bednarchuk, Tamara J.; Kinzhybalo, Vasyl; Pietraszko, Adam
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 5
• Pages of publication: 432 - 441
• a: 6.682 ± 0.003 Å
• b: 11.807 ± 0.004 Å
• c: 14.309 ± 0.004 Å
• α: 68.23 ± 0.03°
• β: 82.13 ± 0.03°
• γ: 84.76 ± 0.03°
• Cell volume: 1037.5 ± 0.7 ų
• Cell temperature: 100 ± 0.13 K
• Ambient diffraction temperature: 100 ± 0.13 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: 0.0574
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0811
• Weighted residual factors for all reflections included in the refinement: 0.0894
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes