Information card for entry 2211130

Structure parameters

• Chemical name: Poly[[bis(μ-1,4-dihydro-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)- 1,8-naphtyridine-3-carboxylato)cadmium(II)] trihydrate]
• Formula: C30 H38 Cd F2 N8 O9
• Calculated formula: C30 H38 Cd F2 N8 O9
• Title of publication: Poly[[bis(μ-1,4-dihydro-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,8-naphthyridine-3-carboxylato)cadmium(II)] trihydrate]
• Authors of publication: Le-Hua Zhang; Zhe An; Ying-Ji Wang; Wei Qi; Ling Zhu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2816 - m2817
• a: 5.5628 ± 0.0003 Å
• b: 22.2025 ± 0.0013 Å
• c: 13.5034 ± 0.0008 Å
• α: 90°
• β: 98.522 ± 0.001°
• γ: 90°
• Cell volume: 1649.36 ± 0.16 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 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: 0.0393
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0871
• Weighted residual factors for all reflections included in the refinement: 0.093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes