Information card for entry 7251718

Structure parameters

• Chemical name: YM314
• Formula: C17 H12 F N O3
• Calculated formula: C17 H12 F N O3
• Title of publication: H-Bond Mediated Photocatalyzed Oxidation of Oximes under visible light and Air. A General Route toward Dioxazoles, Oxadiazoles and Isoxazoles
• Authors of publication: Landais, Yannick; Massad, Younes; Zych, Arkadiusz; Duttine, Mathieu; Robert, Frédéric; Bassani, Dario Maria
• Journal of publication: Green Chemistry
• Year of publication: 2026
• a: 32.317 ± 0.002 Å
• b: 5.8385 ± 0.0004 Å
• c: 7.1851 ± 0.0005 Å
• α: 90°
• β: 90.826 ± 0.003°
• γ: 90°
• Cell volume: 1355.56 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.105
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1186
• Weighted residual factors for all reflections included in the refinement: 0.1398
• Goodness-of-fit parameter for all reflections included in the refinement: 1.096
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No