Information card for entry 4114554

Structure parameters

• Formula: C16 H16 N2 Ni O6
• Calculated formula: C16 H16 N2 Ni O6
• Title of publication: A New Self-Penetrating Uniform Net, (8,4) (or 86), Containing Planar Four-Coordinate Nodes
• Authors of publication: Ming-Liang Tong; Xiao-Ming Chen; Stuart R. Batten
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 16170 - 16171
• a: 16.784 ± 0.005 Å
• b: 5.4457 ± 0.0018 Å
• c: 17.862 ± 0.006 Å
• α: 90°
• β: 105.987 ± 0.005°
• γ: 90°
• Cell volume: 1569.5 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0474
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.104
• Weighted residual factors for all reflections included in the refinement: 0.109
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No