Information card for entry 4002715

Structure parameters

• Formula: C4 H10 N2 O6 Zn
• Calculated formula: C4.0002 H10.0008 N2.0001 O6 Zn
• 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: 8.0919 ± 0.0013 Å
• b: 8.0919 ± 0.0013 Å
• c: 22.4 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1270.2 ± 0.4 ų
• Cell temperature: 350 ± 1 K
• Ambient diffraction temperature: 350 ± 1 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0163
• Residual factor for significantly intense reflections: 0.0144
• Weighted residual factors for significantly intense reflections: 0.0379
• Weighted residual factors for all reflections included in the refinement: 0.0386
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No