Information card for entry 1576892

Structure parameters

• Formula: C58.5 H72.34 Ag2 Cl F12 N8 O8.67 S4
• Calculated formula: C58 H71.338 Ag2 F12 N8 O8.669 S4
• Title of publication: Silver-Catalysed Intermolecular Benzylic-Selective C–H Amidation via Nitrene Transfer
• Authors of publication: Panja, Subir; Trinh, Tuan Anh; Warrington, Ethan M.; Hu, Derek B.; Garman, Leah C.; Guzei, Ilia; Schomaker, Jennifer
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 10.7205 ± 0.0019 Å
• b: 15.731 ± 0.003 Å
• c: 21.503 ± 0.004 Å
• α: 84.243 ± 0.006°
• β: 83.807 ± 0.007°
• γ: 77.184 ± 0.007°
• Cell volume: 3504.4 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0364
• Residual factor for significantly intense reflections: 0.0316
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No