Information card for entry 2203022

Structure parameters

• Chemical name: catena-[μ~6~-1,2,4,5-Benzenetetracarboxylato-tetraaqua-dinickel(II)] dihydrate
• Formula: C10 H14 Ni2 O14
• Calculated formula: C10 H10 Ni2 O14
• Title of publication: <i>catena</i>-[μ~6~-1,2,4,5-Benzenetetracarboxylato-tetraaqua-dinickel(II)] dihydrate
• 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: 10
• Pages of publication: m849 - m850
• a: 6.91 ± 0.001 Å
• b: 7.389 ± 0.001 Å
• c: 8.223 ± 0.001 Å
• α: 90.08 ± 0.07°
• β: 109.83 ± 0.08°
• γ: 93.37 ± 0.07°
• Cell volume: 394.2 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.082
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.094
• Weighted residual factors for all reflections included in the refinement: 0.108
• 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