Information card for entry 7111682

Structure parameters

• Formula: Ba8 Cl Co2 Mn6 O22
• Calculated formula: Ba8 Cl Co2 Mn6 O21.9999
• Title of publication: Ba8Co2Mn6ClO22, a quasi-1D hexagonal perovskite polytype containing new 8H-blocks
• Authors of publication: Iorgulescu, Mihaela; Kabbour, Houria; Tancret, Nathalie; Mentré, Olivier; Roussel, Pascal
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 29
• Pages of publication: 5271 - 5273
• a: 5.7207 ± 0.0002 Å
• b: 5.7207 ± 0.0002 Å
• c: 19.4099 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 550.11 ± 0.04 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• Space group number: 187
• Hermann-Mauguin space group symbol: P -6 m 2
• Hall space group symbol: P -6 2
• Residual factor for all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0569
• Weighted residual factors for all reflections included in the refinement: 0.0571
• Goodness-of-fit parameter for significantly intense reflections: 3.6
• Goodness-of-fit parameter for all reflections included in the refinement: 3.5
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No