Information card for entry 7161064

Structure parameters

• Formula: C12 F10 Se2
• Calculated formula: C12 F10 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: 5.7599 ± 0.0003 Å
• b: 9.4957 ± 0.0005 Å
• c: 25.7505 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1408.41 ± 0.13 ų
• Cell temperature: 299 K
• Ambient diffraction temperature: 299 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0292
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.116
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No