Information card for entry 7012831

Structure parameters

• Common name: Dibarium bischlorotrisoxalatodiiron(ii) tetrahydrate'
• Chemical name: Dibarium bischlorotrisoxalatodiiron(II) tetrahydrate'
• Formula: C12 H16 Ba4 Cl4 Fe4 O32
• Calculated formula: C12 H16 Ba4 Cl4 Fe4 O32
• Title of publication: A new series of layered transition metal oxalates: hydrothermal synthesis, structural and magnetic studies
• Authors of publication: Price, Daniel J.; Powell, Annie K.; Wood, Paul T.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 2478
• a: 22.798 ± 0.005 Å
• b: 8.297 ± 0.002 Å
• c: 9.849 ± 0.002 Å
• α: 90°
• β: 99.9 ± 0.03°
• γ: 90°
• Cell volume: 1835.2 ± 0.7 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: 0.0236
• Residual factor for significantly intense reflections: 0.0191
• Weighted residual factors for all reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0495
• Goodness-of-fit parameter for all reflections: 1.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No