Information card for entry 7207709

Structure parameters

• Formula: C0 H2 Gd K N0 O9 S2
• Calculated formula: Gd H2 K O9 S2
• SMILES: [Gd+3].S(=O)(=O)([O-])[O-].S(=O)(=O)([O-])[O-].[K+].O
• Title of publication: An effective method for the synthesis of 3D inorganic Ln(iii)‒K(i) sulfate open frameworks with unusually high thermal stability: in situ generation of sulfate anions
• Authors of publication: Zhang, Huabin; Zhang, Mingjian; Tian, Chongbin; Li, Ning; Lin, Ping; Li, Zhihua; Du, Shaowu
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2012
• Journal volume: 22
• Journal issue: 14
• Pages of publication: 6831
• a: 10.129 ± 0.005 Å
• b: 8.391 ± 0.003 Å
• c: 10.357 ± 0.007 Å
• α: 90°
• β: 119.152 ± 0.006°
• γ: 90°
• Cell volume: 768.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0237
• Residual factor for significantly intense reflections: 0.0225
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0577
• Goodness-of-fit parameter for all reflections included in the refinement: 1.128
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No