Information card for entry 1576485

Structure parameters

• Formula: C22 H24 F N O7 S
• Calculated formula: C22 H24 F N O7 S
• Title of publication: Se-catalyzed enantioselective lactamization enabled by a <i>N</i>-fluorosulfonyl group: total synthesis of diaporisoindole A.
• Authors of publication: Yamamoto, Daiki; Yamasaki, Shun; Hashimoto, Takuya
• Journal of publication: Chemical science
• Year of publication: 2026
• Journal volume: 17
• Journal issue: 6
• Pages of publication: 3313 - 3319
• a: 10.9165 ± 0.0001 Å
• b: 16.1273 ± 0.0002 Å
• c: 12.2969 ± 0.0001 Å
• α: 90°
• β: 91.946 ± 0.001°
• γ: 90°
• Cell volume: 2163.67 ± 0.04 ų
• Cell temperature: 170 ± 0.1 K
• Ambient diffraction temperature: 170 ± 0.1 K
• Number of distinct elements: 6
• 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: 0.0381
• Residual factor for significantly intense reflections: 0.0345
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.089
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No