Information card for entry 2004288

Structure parameters

• Chemical name: [4-chloro-3-(2-nitrophenylthio)butyl]triphenylstannane
• Formula: C28 H26 Cl N O2 S Sn
• Calculated formula: C28 H26 Cl N O2 S Sn
• SMILES: [Sn](CCC(Sc1c(N(=O)=O)cccc1)CCl)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: [4-Chloro-3-(2-nitrophenylthio)butyl]triphenylstannane
• Authors of publication: Aupers, J. H.; Wardell, J. L.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 12
• Pages of publication: 2559 - 2561
• a: 23.382 ± 0.006 Å
• b: 10.16 ± 0.003 Å
• c: 11.265 ± 0.005 Å
• α: 90°
• β: 92.78 ± 0.03°
• γ: 90°
• Cell volume: 2673 ± 1.6 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.042
• Goodness-of-fit parameter for significantly intense reflections: 0.934
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No