Information card for entry 7245397

Structure parameters

• Formula: C15 H14 O3 S
• Calculated formula: C15 H14 O3 S
• Title of publication: Visible-light-mediated synthesis of β-keto sulfones using g-C3N4 as a recyclable photocatalyst under sustainable conditions
• Authors of publication: Dam, Binoyargha; Sahoo, Ashish Kumar; Patel, Bhisma K.
• Journal of publication: Green Chemistry
• Year of publication: 2022
• Journal volume: 24
• Journal issue: 18
• Pages of publication: 7122 - 7130
• a: 11.5468 ± 0.0016 Å
• b: 10.2038 ± 0.0011 Å
• c: 22.824 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2689.2 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1411
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1496
• Weighted residual factors for all reflections included in the refinement: 0.2039
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No