Information card for entry 2008067

Structure parameters

• Formula: C16 H26 Ni O12 S2
• Calculated formula: C16 H26 Ni O12 S2
• Title of publication: Hexaaquametal(II) 4-styrenesulfonates of manganese, cobalt and nickel
• Authors of publication: Melvin A. Leonard; Philip J. Squattrito; Surendra N. Dubey
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: 35 - 39
• a: 6.292 ± 0.002 Å
• b: 6.934 ± 0.005 Å
• c: 27.315 ± 0.005 Å
• α: 90°
• β: 100.68 ± 0.04°
• γ: 90°
• Cell volume: 1171.1 ± 1 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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 significantly intense reflections: 0.081
• Weighted residual factors for significantly intense reflections: 0.104
• Goodness-of-fit parameter for all reflections included in the refinement: 2.27
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No