Information card for entry 7161178

Structure parameters

• Chemical name: N-(2-(4-methyl-3-oxo-3,4-dihydroquinoxalin-2-yl)phenyl)thiophene-2-carboxamide
• Formula: C20 H15 N3 O2 S
• Calculated formula: C20 H15 N3 O2 S
• Title of publication: Imine-Directed Ru(II)-Catalyzed ortho-C(sp²)–H Amidation of 3-Arylquinoxalin-2(1H)-ones via Nitrene Transfer from Acyl/Heteroacyl Azides
• Authors of publication: Sapra, Shivani; Singh, Sunil Kumar; Singh, Brajendra Kumar
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2026
• a: 11.336 ± 0.0008 Å
• b: 7.344 ± 0.0005 Å
• c: 20.122 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1675.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.1189
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.1739
• Weighted residual factors for all reflections included in the refinement: 0.2107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No