Information card for entry 4114880

Structure parameters

• Common name: Sn4(THME)2[OBu(OMe)]2
• Formula: C20 H40 O8 Sn4
• Calculated formula: C20 H40 O8 Sn4
• SMILES: [Sn]123[O]4[Sn]56[O]7[Sn]89[O]([Sn]([O]1C[C@H](C)CC)([O]2CC(C[O]35)(C[O]68)C)[O]9C[C@H](C)CC)CC(C4)(C7)C.[Sn]123[O]4[Sn]56[O]7[Sn]89[O]([Sn]([O]1C[C@@H](C)CC)([O]2CC(C[O]35)(C[O]68)C)[O]9C[C@@H](C)CC)CC(C4)(C7)C
• Title of publication: Chemistry of a Novel Family of Tridentate Alkoxy Tin(II) Clusters
• Authors of publication: Timothy J. Boyle; Judith M. Segall; Todd M. Alam; Mark A. Rodriguez; Jessica M. Santana
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2002
• Journal volume: 124
• Pages of publication: 6904 - 6913
• a: 15.051 ± 0.002 Å
• b: 12.1069 ± 0.0018 Å
• c: 15.607 ± 0.002 Å
• α: 90°
• β: 92.027 ± 0.003°
• γ: 90°
• Cell volume: 2842.1 ± 0.7 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 4
• 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: 0.0312
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0606
• Weighted residual factors for all reflections included in the refinement: 0.0625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No