Information card for entry 2218787

Structure parameters

• Chemical name: Hexaaquamagnesium(II) bis(D-camphor-10-sulfonate)
• Formula: C20 H42 Mg O14 S2
• Calculated formula: C20 H42 Mg O14 S2
• SMILES: [Mg]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].S(=O)(=O)([O-])C[C@@]12C(=O)C[C@@H](CC1)C2(C)C.S(=O)(=O)([O-])C[C@@]12C(=O)C[C@@H](CC1)C2(C)C
• Title of publication: Hexaaquamagnesium(II) bis(<small>D</small>-camphor-10-sulfonate)
• Authors of publication: Jeremić, Dejan; Kaluderović, Goran N.; Brčeski, Ilija; Gómez-Ruiz, Santiago; Andelković, Katarina K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m952
• a: 11.75456 ± 0.0001 Å
• b: 7.0595 ± 0.00008 Å
• c: 17.22794 ± 0.00015 Å
• α: 90°
• β: 93.1811 ± 0.0008°
• γ: 90°
• Cell volume: 1427.39 ± 0.02 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0347
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.0673
• Weighted residual factors for all reflections included in the refinement: 0.069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.987
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes