Information card for entry 2014763

Structure parameters

• Chemical name: Poly[bis[(pyridine-4-carboxylato)zinc(II)]-di-μ~3~-phosphato]
• Formula: C12 H12 N2 O12 P2 Zn2
• Calculated formula: C12 H12 N2 O12 P2 Zn2
• Title of publication: A new layered zinc phosphate templated by protonated isonicotinate, [Zn~2~(C~6~H~5~NO~2~)~2~(HPO~4~)~2~]
• Authors of publication: Guang-Sheng Guo; Yong-Ge Wei; Jing Li; Ying Wang; Hong-You Guo
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 2
• Pages of publication: m87 - m89
• a: 20.56 ± 0.004 Å
• b: 8.5138 ± 0.0017 Å
• c: 10.387 ± 0.002 Å
• α: 90°
• β: 97.46 ± 0.03°
• γ: 90°
• Cell volume: 1802.8 ± 0.6 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 6
• 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: 0.0528
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0913
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes