Information card for entry 7134304

Structure parameters

• Formula: C11 H8 Br F2 N O
• Calculated formula: C11 H8 Br F2 N O
• Title of publication: Photocatalytically switchable chemoselective difluoramidation of olefins for the synthesis of diversified difluoro-γ-lactams.
• Authors of publication: Cao, Tian-Zheng; Nie, Cai-Jian; Li, Jing; Liu, Ming-Dong; Wang, Zi-Tong; Kong, Yi-Fei; Wang, Xin; Sun, Yuan-Yuan; Li, Jin-Heng; Zhu, Yan-Ping
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 27
• Pages of publication: 5150 - 5153
• a: 23.396 ± 0.01 Å
• b: 6.177 ± 0.003 Å
• c: 16.234 ± 0.007 Å
• α: 90°
• β: 111.845 ± 0.006°
• γ: 90°
• Cell volume: 2177.6 ± 1.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0683
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1137
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No