Information card for entry 4114879

Structure parameters

• Common name: Sn4(THME)2(OEt)2
• Formula: C14 H28 O8 Sn4
• Calculated formula: C14 H28 O8 Sn4
• SMILES: [Sn]123[O]4[Sn]5([O]([Sn]67[O]8[Sn]9([O]1CC(C4)(C8)C)[O]7CC(C[O]56)(C[O]29)C)CC)[O]3CC
• 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: 8.845 ± 0.003 Å
• b: 10.63 ± 0.003 Å
• c: 12.957 ± 0.004 Å
• α: 98.746 ± 0.005°
• β: 101.834 ± 0.005°
• γ: 106.563 ± 0.005°
• Cell volume: 1113.7 ± 0.6 ų
• Cell temperature: 168 ± 2 K
• Ambient diffraction temperature: 168 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.0849
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 0.519
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No