Information card for entry 7101939

Structure parameters

• Formula: C8 H4 N4 Ni2 O10 S2
• Calculated formula: C8 H4 N4 Ni2 O10 S2
• Title of publication: Magnetic canting or not? Two isomorphous 3D CoII and NiII coordination polymers with the rare non-interpenetrated (10,3)-d topological network, showing spin-canted antiferromagnetism only in the CoII system.
• Authors of publication: Li, Jian-Rong; Yu, Qun; Tao, Ying; Bu, Xian-He; Ribas, Joan; Batten, Stuart R
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 22
• Pages of publication: 2290 - 2292
• a: 7.1244 ± 0.0014 Å
• b: 7.1131 ± 0.0014 Å
• c: 13.153 ± 0.003 Å
• α: 90°
• β: 90.85 ± 0.03°
• γ: 90°
• Cell volume: 666.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0308
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0617
• Weighted residual factors for all reflections included in the refinement: 0.0631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No