Information card for entry 7107937

Structure parameters

• Formula: C30 H41 N O4 S Sn
• Calculated formula: C30 H41 N O4 S Sn
• SMILES: [Sn]1(CCCC)(CCCC)C[C@@]2([C@@H](N(S(=O)(=O)c3ccc(C)cc3)CC2=C1)c1ccc(C)cc1)C(=O)OC
• Title of publication: Unexpected formation of stannolanes and trigonal bipyramidal tin complexes by radical cyclization reaction
• Authors of publication: Akio Kamimura; Shingo Ishikawa; Fumiaki Noguchi; Takaaki Moriyama; Masahiro So; Toshihiro Murafuji; Hidemitsu Uno
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 6592
• a: 8.6061 ± 0.0008 Å
• b: 9.5866 ± 0.0011 Å
• c: 19.364 ± 0.002 Å
• α: 82.273 ± 0.004°
• β: 80.021 ± 0.003°
• γ: 89.854 ± 0.003°
• Cell volume: 1558.8 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.1796
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No