Information card for entry 2202552

Structure parameters

• Chemical name: Aqua(4,4-bipyridine)phthalatonickel(II) trihydrate
• Formula: C18 H20 N2 Ni O8
• Calculated formula: C18 H20 N2 Ni O8
• Title of publication: Aqua(4,4-bipyridine)phthalatonickel(II) trihydrate
• Authors of publication: Yang, Shi-Yao; Long, La-Sheng; Huang, Rong-Bin; Zheng, Lan-Sun; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 7
• Pages of publication: m507 - m509
• a: 11.134 ± 0.002 Å
• b: 8.379 ± 0.002 Å
• c: 11.265 ± 0.002 Å
• α: 90°
• β: 115.39 ± 0.03°
• γ: 90°
• Cell volume: 949.4 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.091
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.137
• Weighted residual factors for all reflections included in the refinement: 0.153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes