Information card for entry 2017680

Structure parameters

• Chemical name: Tetrapotassium [μ~2~-<i>N</i>-carboxylato-D-penicillaminato(3-)- 5:6κ^2^<i>S</i>:<i>S</i>][μ~2~-D-penicillaminato(1-)- 2,3κ^2^<i>S</i>:<i>S</i>]tetrakis[μ~2~-D-penicillaminato(2-)]- 1:2κ^3^<i>N</i>,<i>S</i>:<i>S</i>; 1:6κ^3^<i>N</i>,<i>S</i>:<i>S</i>; 3:4κ^3^<i>S</i>:<i>N</i>,<i>S</i>; 4:5κ^3^<i>N</i>,<i>S</i>:<i>S</i>-2,3,5,6-tetragold(I)-1,4-dinickel(II) ethanol monosolvate decahydrate
• Formula: C33 H79 Au4 K4 N6 Ni2 O25 S6
• Calculated formula: C33 H79 Au4 K4 N6 Ni2 O25 S6
• Title of publication: Tetrapotassium [μ~2~-<i>N</i>-carboxylato-<small>D</small>-penicillaminato(3‒)-5:6κ^2^<i>S</i>:<i>S</i>][μ~2~-<small>D</small>-penicillaminato(1‒)-2:3κ^2^<i>S</i>:<i>S</i>]tetrakis[μ~2~-<small>D</small>-penicillaminato(2‒)]-1:2κ^3^<i>N</i>,<i>S</i>:<i>S</i>;1:6κ^3^<i>N</i>,<i>S</i>:<i>S</i>;3:4κ^3^<i>S</i>:<i>N</i>,<i>S</i>;4:5κ^3^<i>N</i>,<i>S</i>:<i>S</i>-2,3,5,6-tetragold(I)-1,4-dinickel(II) ethanol monosolvate decahydrate
• Authors of publication: Hashimoto, Yuji; Taguchi, Mai; Yoshinari, Nobuto; Konno, Takumi
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: m160 - m162
• a: 9.9638 ± 0.0018 Å
• b: 22.644 ± 0.004 Å
• c: 14.723 ± 0.003 Å
• α: 90°
• β: 97.998 ± 0.007°
• γ: 90°
• Cell volume: 3289.5 ± 1.1 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.036
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0589
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes