Information card for entry 2206191

Structure parameters

• Chemical name: Hexaaquanickel(II) bis(thiodiacetato-κ^3^O,S,O')nickel(II) tetrahydrate
• Formula: C8 H28 Ni2 O18 S2
• Calculated formula: C8 H28 Ni2 O18 S2
• Title of publication: Hexaaquanickelate(II) bis(thiodiacetato-κ^3^<i>O,S,O</i>')nickel(II) tetrahydrate
• Authors of publication: Tian-Tian Pan; Jian-Rong Su; Duan-Jun Xu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 7
• Pages of publication: m1376 - m1378
• a: 18.8369 ± 0.0005 Å
• b: 13.4729 ± 0.0003 Å
• c: 8.9472 ± 0.0002 Å
• α: 90°
• β: 101.639 ± 0.008°
• γ: 90°
• Cell volume: 2224 ± 0.11 ų
• Cell temperature: 295 ± 3 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.022
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.061
• Weighted residual factors for all reflections included in the refinement: 0.061
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes