Information card for entry 7014633

Structure parameters

• Formula: C14 H16 O14 P2 Zn3
• Calculated formula: C14 H16 O14 P2 Zn3
• Title of publication: Co₃(2-OOCC₆H₄PO₃)₂(H₂O)₃·H₂O: a layered metal phosphonate showing reversible dehydration-rehydration behavior and ferrimagnetism.
• Authors of publication: Wang, Peng-Fei; Cao, Deng-Ke; Bao, Song-Song; Jin, Hao-Jun; Li, Yi-Zhi; Wang, Tian-Wei; Zheng, Li-Min
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 6
• Pages of publication: 1307 - 1312
• a: 11.764 ± 0.002 Å
• b: 7.2014 ± 0.0013 Å
• c: 24.274 ± 0.004 Å
• α: 90°
• β: 100.887 ± 0.003°
• γ: 90°
• Cell volume: 2019.4 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.1283
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No