Information card for entry 1519932

Structure parameters

• Common name: TripTpSnCpMe5
• Formula: C48.5 H70 Sn
• Calculated formula: C48.5 H70 Sn
• SMILES: [Sn]12([c]3([cH]1(C)[cH]2(c(c3C)C)C)C)c1c(c2c(cc(C(C)C)cc2C(C)C)C(C)C)cccc1c1c(cc(cc1C(C)C)C(C)C)C(C)C.CCCCC
• Title of publication: A nitrogen-base catalyzed generation of organotin(ii) hydride from an organotin trihydride under reductive dihydrogen elimination
• Authors of publication: Sindlinger, Christian P.; Stasch, Andreas; Bettinger, Holger F.; Wesemann, Lars
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 8
• Pages of publication: 4737
• a: 15.9849 ± 0.0004 Å
• b: 15.9056 ± 0.0004 Å
• c: 17.7408 ± 0.0004 Å
• α: 90°
• β: 100.754 ± 0.001°
• γ: 90°
• Cell volume: 4431.37 ± 0.19 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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: 0.0448
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0705
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No