Information card for entry 7159861

Structure parameters

• Formula: C24 H20 N2 O7 S2
• Calculated formula: C24 H20 N2 O7 S2
• Title of publication: Direct access to pyrrole anhydrides <i>via</i> oxidative self-coupling of pyrrole carboxaldehydes.
• Authors of publication: Panday, Surabhi; Maity, Tapas; Bhatti, Pratibha; Laha, Joydev K.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2024
• Journal volume: 22
• Journal issue: 15
• Pages of publication: 3045 - 3052
• a: 15.7 ± 0.002 Å
• b: 11.2137 ± 0.0013 Å
• c: 13.4533 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2368.5 ± 0.5 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0988
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No