Information card for entry 4002726

Structure parameters

• Formula: C4 H10 Fe N2 O6
• Calculated formula: C3.9999 H9.9993 Fe N1.9998 O6
• Title of publication: Phase Transitions and Coexistence of Magnetic and Electric Orders in the Methylhydrazinium Metal Formate Frameworks
• Authors of publication: Mączka, Mirosław; Gągor, Anna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam
• Journal of publication: Chemistry of Materials
• Year of publication: 2017
• Journal volume: 29
• Journal issue: 5
• Pages of publication: 2264
• a: 8.1171 ± 0.0002 Å
• b: 8.1171 ± 0.0002 Å
• c: 22.5999 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1289.55 ± 0.06 ų
• Cell temperature: 280 ± 1 K
• Ambient diffraction temperature: 280 ± 1 K
• Number of distinct elements: 5
• Space group number: 161
• Hermann-Mauguin space group symbol: R 3 c :H
• Hall space group symbol: R 3 -2"c
• Residual factor for all reflections: 0.0229
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0399
• Weighted residual factors for all reflections included in the refinement: 0.0416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No