Information card for entry 7203914

Structure parameters

• Common name: Co-DAF4
• Formula: C11.56 H26.43 Al7.35 Co1.65 N1.65 O37.05 P9
• Calculated formula: C13.2 Al7.35 Co1.65 O37.04 P9
• Title of publication: Evidence for ordering of cobalt ions in the microporous solid acid catalyst CoDAF-4 by single crystal X-ray diffraction and resonant X-ray powder diffraction
• Authors of publication: Barrett, P. A.; Jones, R. H.
• Journal of publication: Physical Chemistry Chemical Physics
• Year of publication: 2000
• Journal volume: 2
• Journal issue: 3
• Pages of publication: 407
• a: 13.192 ± 0.003 Å
• b: 13.192 ± 0.003 Å
• c: 46.149 ± 0.009 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6955 ± 3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.1128
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for all reflections: 0.1774
• Weighted residual factors for significantly intense reflections: 0.1453
• Goodness-of-fit parameter for all reflections: 0.88
• Goodness-of-fit parameter for significantly intense reflections: 1.226
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No