Information card for entry 2210532

Structure parameters

• Chemical name: Tetrakis(μ~3~-methanol)bis(methanol-κ<i>O</i>)(μ~2~-tri-<i>tert</i>- butoxysilanethiolato-κ^3^S;S,O)bis(tri-<i>tert</i>-butoxysilanethiolato- κ^2^<i>S</i>,<i>O</i>)tetrasodium(I)
• Formula: C54 H132 Na4 O18 S4 Si4
• Calculated formula: C54 H132 Na4 O18 S4 Si4
• SMILES: [O](C(C)(C)C)([Si]1(OC(C)(C)C)OC(C)(C)C)[Na]23([O](C(C)(C)C)[Si](OC(C)(C)C)(OC(C)(C)C)S2)[S]1[Na]1([OH]3C)([OH]C)[OH](C)[Na]2([OH]1C)([OH]C)[OH](C)[Na]13([O](C(C)(C)C)[Si](OC(C)(C)C)(OC(C)(C)C)S1)[O](C(C)(C)C)[Si](OC(C)(C)C)(OC(C)(C)C)[S]23
• Title of publication: Tetrakis(μ~2~-methanol)bis(methanol-κ<i>O</i>)(μ~2~-tri-<i>tert</i>-butoxysilanethiolato-κ^3^<i>S</i>:<i>S</i>,<i>O</i>)bis(tri-<i>tert</i>-butoxysilanethiolato-κ^2^<i>S</i>,<i>O</i>)tetrasodium(I)
• Authors of publication: Magdalena Kloskowska; Jarosław Chojnacki; Wiesław Wojnowski; Barbara Becker
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: m2476 - m2478
• a: 8.298 ± 0.002 Å
• b: 14.988 ± 0.003 Å
• c: 17.932 ± 0.004 Å
• α: 101.9 ± 0.03°
• β: 99.64 ± 0.03°
• γ: 103.38 ± 0.03°
• Cell volume: 2068.1 ± 0.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0373
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1446
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes