Information card for entry 7049623

Structure parameters

• Formula: C11 H9 Cu O6 P
• Calculated formula: C11 H9 Cu O6 P
• Title of publication: Polymorphic layered copper phosphonates: exfoliation and proton conductivity studies.
• Authors of publication: Liu, Bei; Liu, Jing-Cui; Shen, Yang; Feng, Jian-Shen; Bao, Song-Song; Zheng, Li-Min
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 19
• Pages of publication: 6539 - 6545
• a: 5.1011 ± 0.0006 Å
• b: 6.047 ± 0.0007 Å
• c: 18.034 ± 0.002 Å
• α: 84.761 ± 0.008°
• β: 87.211 ± 0.008°
• γ: 74.855 ± 0.007°
• Cell volume: 534.54 ± 0.11 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1092
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1254
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.001
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No