Information card for entry 4343091

Structure parameters

• Formula: C65 H68 Si Sn2
• Calculated formula: C65 H68 Si Sn2
• SMILES: [Sn@]12([Sn@@](c3c4c1ccc1c4c(cc3)CC1)(C=C2[Si](C)(C)C)c1c(cccc1c1c(C)cc(cc1C)C)c1c(cc(C)cc1C)C)c1c(cccc1c1c(cc(C)cc1C)C)c1c(cc(cc1C)C)C.[Sn@@]12([Sn@](c3c4c1ccc1c4c(cc3)CC1)(C=C2[Si](C)(C)C)c1c(cccc1c1c(C)cc(cc1C)C)c1c(cc(C)cc1C)C)c1c(cccc1c1c(cc(C)cc1C)C)c1c(cc(cc1C)C)C
• Title of publication: Reversibility in Reactions of Linker-Bridged Distannenes with Terminal Alkynes at Ambient Temperature.
• Authors of publication: Schneider, Julia; Henning, Jens; Edrich, Jessica; Schubert, Hartmut; Wesemann, Lars
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 6020 - 6027
• a: 13.3712 ± 0.0004 Å
• b: 17.0316 ± 0.0006 Å
• c: 24.0193 ± 0.0008 Å
• α: 90°
• β: 99.081 ± 0.002°
• γ: 90°
• Cell volume: 5401.4 ± 0.3 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0799
• Weighted residual factors for all reflections included in the refinement: 0.086
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No