Information card for entry 4336655

Structure parameters

• Formula: C10 H2 Co2 O8
• Calculated formula: C10 H2 Co2 O8
• Title of publication: Neutron Diffraction Studies of the Molecular Compound [Co2(bta)]n (H4bta =1,2,4,5-Benzenetetracarboxylic Acid): In the Quest of Canted Ferromagnetism
• Authors of publication: Oscar Fabelo; Laura Cañadillas-Delgado; Jorge Pasán; Pau Díaz-Gallifa; Catalina Ruiz-Pérez; Francesc Lloret; Miguel Julve; Inés Puente Orench; Javier Campo; Juan Rodríguez-Carvajal
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 12818 - 12827
• a: 6.1453 ± 0.0005 Å
• b: 17.465 ± 0.0009 Å
• c: 4.5525 ± 0.0005 Å
• α: 90°
• β: 115.763 ± 0.005°
• γ: 90°
• Cell volume: 440.04 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.039
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections included in the refinement: 0.0909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.173
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mokα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No