Information card for entry 1504755

Structure parameters

• Formula: C29 H32 N O P Sn
• Calculated formula: C29 H32 N O P Sn
• SMILES: P(=O)(N([C@@H]([Sn](C)(C)C)c1ccccc1)Cc1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Asymmetric deprotonation-substitution of N-Pop-benzylamines using [RLi/(-)-sparteine]. Enantioselective sequential reactions and synthesis of N-heterocycles.
• Authors of publication: Oña-Burgos, Pascual; Fernández, Ignacio; Roces, Laura; Torre-Fernández, Laura; García-Granda, Santiago; López-Ortiz, Fernando
• Journal of publication: Organic letters
• Year of publication: 2008
• Journal volume: 10
• Journal issue: 15
• Pages of publication: 3195 - 3198
• a: 11.524 ± 0.0001 Å
• b: 9.198 ± 0.0001 Å
• c: 13.4063 ± 0.0001 Å
• α: 90°
• β: 94.931 ± 0.001°
• γ: 90°
• Cell volume: 1415.78 ± 0.02 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.03
• Residual factor for significantly intense reflections: 0.0251
• Weighted residual factors for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections included in the refinement: 0.0561
• Goodness-of-fit parameter for all reflections included in the refinement: 0.934
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No