Information card for entry 7131317

Structure parameters

• Formula: C23 H20 O S2
• Calculated formula: C23 H20 O S2
• Title of publication: Construction of cyclopenta[b]dihydronaphthofurans via TsOH-catalyzed consecutive biscyclization of dithioallylic alcohols and 1-styrylnaphthols
• Authors of publication: Li, He-Ping; Wu, Xiao-Ling; Zhan, Gu; Fu, Xue-Ju; Chen, Jian-Hua; He, Xiang-Hong; Han, Bo
• Journal of publication: Chemical Communications
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 16
• Pages of publication: 2275 - 2278
• a: 11.0348 ± 0.0009 Å
• b: 18.794 ± 0.0017 Å
• c: 9.6827 ± 0.0006 Å
• α: 90°
• β: 111.244 ± 0.004°
• γ: 90°
• Cell volume: 1871.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0489
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1115
• Weighted residual factors for all reflections included in the refinement: 0.12
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No