Information card for entry 8103178

Structure parameters

• Chemical name: bis[bisaqua-bis(2,2'-bipyridine) nickel(ii)]- (9,10-dioxo-9,10-dihydroanthracene-2,6-disulfonate dinitrate dihydrate
• Formula: C54 H50 N10 Ni2 O20 S2
• Calculated formula: C54 H50 N10 Ni2 O20 S2
• Title of publication: Crystal structure of bis[bisaqua-bis(2,2'-bipyridine)-nickel(II)](9,10-dioxo-9,10-anthracene-2,6-disulfonate) dinitrate dihydrate, [Ni(H2O)2(C10H8N2)2]2[C14H6S2O8][NO3]2 · 2H2O
• Authors of publication: Zhaoxun Lian; Ning Zhao; Fengxia Yang; Ping Liu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 3
• Pages of publication: 425
• a: 9.6994 ± 0.0002 Å
• b: 25.2194 ± 0.0004 Å
• c: 11.2571 ± 0.0002 Å
• α: 90°
• β: 93.788 ± 0.002°
• γ: 90°
• Cell volume: 2747.62 ± 0.09 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0595
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1541
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No