Information card for entry 4315838

Structure parameters

• Formula: C20 H41 Na O17 Se8 Sn6
• Calculated formula: C20 H41 Na O17 Se8 Sn6
• SMILES: [Na+].[Sn]123([Se][Sn]45([Se][Sn]6([Se]1)([Se]24)[O]=C(O)CC6)OC(=O)CC5)[O]=C(O)CC3.[Sn]123([Se][Sn]45([Se][Sn]6([Se]1)([Se]24)[O]=C(O)CC6)OC(=O)CC5)OC(=O)CC3.CO.CO.O.O.O
• Title of publication: Organotin Chalcogenide Salts: Synthesis, Characterization, and Extended Crystal Structures
• Authors of publication: Zohreh Hassanzadeh Fard; Małgorzata Hołyńska; Stefanie Dehnen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 5748 - 5752
• a: 10.964 ± 0.003 Å
• b: 15.478 ± 0.004 Å
• c: 15.943 ± 0.004 Å
• α: 102.34 ± 0.03°
• β: 106.15 ± 0.03°
• γ: 105.18 ± 0.03°
• Cell volume: 2385.3 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0392
• Residual factor for significantly intense reflections: 0.0294
• Weighted residual factors for significantly intense reflections: 0.0659
• Weighted residual factors for all reflections included in the refinement: 0.0688
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No