Information card for entry 7161065

Structure parameters

• Formula: C10 F8 N2 Se2
• Calculated formula: C10 F8 N2 Se2
• Title of publication: PyfSeTs as a Novel and Photosensitive Reagent for the Green Light-Induced Arene C-H Selenenylation: A Verstile Strategy for the Synthesis of Aryl Selenides
• Authors of publication: Shi, Haoliang; Qu, Huorong; Wang, Xinyan; Wei, Jinlian; Wu, Shanchao; Zhang, Yongqiang
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2025
• a: 9.8337 ± 0.0004 Å
• b: 11.1932 ± 0.0005 Å
• c: 24.2439 ± 0.0012 Å
• α: 90°
• β: 96.043 ± 0.003°
• γ: 90°
• Cell volume: 2653.7 ± 0.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0607
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1065
• Weighted residual factors for all reflections included in the refinement: 0.1107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No