Information card for entry 8102942

Structure parameters

• Chemical name: magnesium diammonium hexathiodiphosphate(IV) octahydrate
• Formula: H24 Mg N2 O8 P2 S6
• Calculated formula: H24 Mg N2 O8 P2 S6
• Title of publication: Crystal structure of hexaaquamagnesium diammonium hexathiodiphosphate (IV) dihydrate, [Mg(H~2~O)~6~](NH~4~)~2~[P~2~S~6~] · 2H~2~O
• Authors of publication: Hinrichs, F.; Gjikaj, M.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2006
• Journal volume: 221
• Journal issue: 2
• Pages of publication: 121 - 122
• a: 10.961 ± 0.002 Å
• b: 6.8664 ± 0.0006 Å
• c: 12.981 ± 0.002 Å
• α: 90°
• β: 111.19 ± 0.01°
• γ: 90°
• Cell volume: 910.9 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0331
• Residual factor for significantly intense reflections: 0.027
• Weighted residual factors for significantly intense reflections: 0.0616
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No