Information card for entry 7127130

Structure parameters

• Formula: C15 H18 N2 O
• Calculated formula: C15 H18 N2 O
• Title of publication: Electrochemical decarboxylative C3 alkylation of quinoxalin-2(1<i>H</i>)-ones with <i>N</i>-hydroxyphthalimide esters.
• Authors of publication: Niu, Kaikai; Song, Lingyun; Hao, Yanke; Liu, Yuxiu; Wang, Qingmin
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 78
• Pages of publication: 11673 - 11676
• a: 10.3988 ± 0.0009 Å
• b: 11.976 ± 0.0009 Å
• c: 12.1316 ± 0.0008 Å
• α: 86.151 ± 0.006°
• β: 70.363 ± 0.007°
• γ: 65.045 ± 0.008°
• Cell volume: 1285.2 ± 0.2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0521
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1099
• Weighted residual factors for all reflections included in the refinement: 0.1162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No