Information card for entry 2215729

Structure parameters

• Chemical name: Di-μ-hydroxido-bis[aquatrichloridotin(IV)] benzene hemisolvate monohydrate
• Formula: C3 H11 Cl6 O5 Sn2
• Calculated formula: C3 H11 Cl6 O5 Sn2
• SMILES: c1ccccc1.[OH2][Sn]1([OH][Sn](Cl)(Cl)(Cl)([OH2])[OH]1)(Cl)(Cl)Cl.O
• Title of publication: Di-μ-hydroxido-bis[aquatrichloridotin(IV)] benzene hemisolvate monohydrate
• Authors of publication: Müller, Manuela; Lerner, Hans-Wolfram; Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2765 - m2765
• a: 6.3682 ± 0.0007 Å
• b: 10.8299 ± 0.0012 Å
• c: 11.8619 ± 0.0013 Å
• α: 74.18 ± 0.009°
• β: 78.048 ± 0.009°
• γ: 88.588 ± 0.009°
• Cell volume: 769.59 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0508
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.1017
• Weighted residual factors for all reflections included in the refinement: 0.107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes