Information card for entry 2228725

Structure parameters

• Chemical name: Poly[[μ~2~-aqua-tetraaquadi-μ~3~-malonato-nickel(II)strontium(II)] dihydrate]
• Formula: C6 H18 Ni O15 Sr
• Calculated formula: C6 H18 Ni O15 Sr
• SMILES: [Sr]([OH2])[OH2].[Ni]12(OC(=O)CC(=O)O1)OC(=O)CC(=O)O2.O.O.O.O.O
• Title of publication: Poly[[μ~2~-aqua-tetraaquadi-μ~3~-malonato-nickel(II)strontium(II)] dihydrate]
• Authors of publication: Guo, Ming-Lin; Liu, Long; Lu, Cong-Cong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 1
• Pages of publication: m19 - m20
• a: 6.7745 ± 0.0014 Å
• b: 14.22 ± 0.003 Å
• c: 15.629 ± 0.003 Å
• α: 90°
• β: 101.1 ± 0.03°
• γ: 90°
• Cell volume: 1477.4 ± 0.5 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.0382
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes