Information card for entry 2207365

Structure parameters

• Formula: C18 H19 N O S Sn
• Calculated formula: C18 H19 N O S Sn
• SMILES: c1(nc(c(o1)c1ccccc1)c1ccccc1)S[Sn](C)(C)C
• Title of publication: 4,5-Diphenyl-2-(trimethylstannylsulfanyl)-1,3-oxazole
• Authors of publication: Ji-Kun Li; Ru-Fen Zhang; Chun-Lin Ma
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 11
• Pages of publication: m2457 - m2458
• a: 9.267 ± 0.003 Å
• b: 9.824 ± 0.003 Å
• c: 20.477 ± 0.006 Å
• α: 90°
• β: 102.144 ± 0.004°
• γ: 90°
• Cell volume: 1822.5 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.042
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.086
• Weighted residual factors for all reflections included in the refinement: 0.097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes