Information card for entry 1560742

Structure parameters

• Formula: C12 H14 Ba Co O8 P2
• Calculated formula: C12 H12 Ba Co O8 P2
• Title of publication: Hydrothermal syntheses and characterization of phenyl- and benzyl-phosphonates and ethylene- and propylene-diphosphonates of cobalt(II), ACo(O3PR)2·xH2O and ACo(O3P-R-PO3)·2H2O (A = Ca, Sr, Ba; R = Ph, CH2Ph, -CH2CH2-, -CH2CH2CH2-)
• Authors of publication: Elias Jesu Packiam, D.; Vidyasagar, Kanamaluru
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2018
• Journal volume: 268
• Pages of publication: 115 - 122
• a: 8.8912 ± 0.0011 Å
• b: 13.8502 ± 0.0016 Å
• c: 14.233 ± 0.002 Å
• α: 91.703 ± 0.007°
• β: 93.394 ± 0.007°
• γ: 90.035 ± 0.007°
• Cell volume: 1748.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0884
• Residual factor for significantly intense reflections: 0.0705
• Weighted residual factors for significantly intense reflections: 0.1855
• Weighted residual factors for all reflections included in the refinement: 0.2103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No