Information card for entry 7035274

Structure parameters

• Formula: C3 H7 Mn N O6
• Calculated formula: C3 H7 Mn N O6
• Title of publication: Probing ferroic transitions in a multiferroic framework family: a neutron diffraction study of the ammonium transition metal formates.
• Authors of publication: Lawler, James M. M.; Manuel, Pascal; Thompson, Amber L.; Saines, Paul J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 25
• Pages of publication: 11613 - 11620
• a: 12.65088 ± 0.00013 Å
• b: 12.65088 ± 0.00013 Å
• c: 8.54951 ± 0.00009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1184.99 ± 0.02 ų
• Cell temperature: 30 K
• Ambient diffraction temperature: 30 K
• Number of distinct elements: 5
• Space group number: 173
• Hermann-Mauguin space group symbol: P 63
• Hall space group symbol: P 6c
• Residual factor for all reflections: 0.0388
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for all reflections: 0.0744
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9457
• Diffraction radiation wavelength: 0.6889 Å
• Diffraction radiation type: Synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No