Information card for entry 7135941

Structure parameters

• Formula: C16 H10 O S
• Calculated formula: C16 H10 O S
• Title of publication: Accessing thiophene-fused furans via visible light photoredoxcatalyzed [3+2]-annulation reaction
• Authors of publication: Rani, Himani; Hussain , Yaseen; Chauhan, Pankaj
• Journal of publication: Chemical Communications
• Year of publication: 2026
• a: 18.2171 ± 0.0012 Å
• b: 5.8641 ± 0.0004 Å
• c: 22.9814 ± 0.0017 Å
• α: 90°
• β: 109.053 ± 0.002°
• γ: 90°
• Cell volume: 2320.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0661
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.173
• Weighted residual factors for all reflections included in the refinement: 0.1757
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No