Information card for entry 4341742

Structure parameters

• Formula: Cl Fe3 Na2 O14 P4 Rb
• Calculated formula: Cl Fe3 Na2 O14 P4 Rb
• 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: 20.827 ± 0.004 Å
• b: 5.192 ± 0.001 Å
• c: 13.709 ± 0.003 Å
• α: 90°
• β: 118.82 ± 0.03°
• γ: 90°
• Cell volume: 1298.8 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.033
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0779
• Weighted residual factors for all reflections included in the refinement: 0.0793
• Goodness-of-fit parameter for all reflections included in the refinement: 1.138
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No