Information card for entry 2018455

Structure parameters

• Chemical name: Dibromodiphenylstannane
• Formula: C12 H10 Br2 Sn
• Calculated formula: C12 H10 Br2 Sn
• SMILES: [Sn](Br)(Br)(c1ccccc1)c1ccccc1
• Title of publication: Dibromodiphenylstannane: isolated centrosymmetric dimers as a new structure motif for the intermolecular association of diorganotin(IV) dihalides
• Authors of publication: Ye, Fei; Reuter, Hans
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: m104 - m108
• a: 8.9553 ± 0.0005 Å
• b: 8.7468 ± 0.0005 Å
• c: 17.0671 ± 0.0008 Å
• α: 90°
• β: 99.713 ± 0.002°
• γ: 90°
• Cell volume: 1317.71 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0214
• Residual factor for significantly intense reflections: 0.0167
• Weighted residual factors for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections included in the refinement: 0.0389
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes