Information card for entry 4341744

Structure parameters

• Formula: Cl Cs Fe3 K2 O14 P4
• Calculated formula: Cl Cs Fe3 K2 O14 P4
• Title of publication: M3(P2O7)2(2-)-Type Open Frameworks Featuring [M2O8] and [M3O12] Multinuclear Transition-Metal Oxide Units. Serendipitous Synthesis of Six Polymorphic Salt-Inclusion Magnetic Solids: Na2M3(P2O7)2·ACl (M = Mn, Fe; A = Rb, Cs) and K2M3(P2O7)2·CsCl (M = Fe, Mn).
• Authors of publication: Gao, Jianhua; Li, Jian; Sulejmanovic, Dino; Hwu, Shiou-Jyh
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 3
• Pages of publication: 1136 - 1144
• a: 5.3125 ± 0.0011 Å
• b: 7.613 ± 0.0015 Å
• c: 9.6697 ± 0.0019 Å
• α: 79.41 ± 0.03°
• β: 76.04 ± 0.03°
• γ: 89.66 ± 0.03°
• Cell volume: 372.76 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0443
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1138
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No