Information card for entry 1557980

Structure parameters

• Common name: 2,3-Diethylbenzo[g]quinoxaline
• Chemical name: 2,3-Diethylbenzo[<i>g</i>]quinoxaline
• Formula: C16 H16 N2
• Calculated formula: C16 H16 N2
• SMILES: CCc1c(CC)nc2c(cc3ccccc3c2)n1
• Title of publication: 2,3-Diethylbenzo[<i>g</i>]quinoxaline
• Authors of publication: Crundwell, Guy; Leeds, Ashley
• Journal of publication: IUCrData
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 4
• Pages of publication: x200454
• a: 13.93535 ± 0.00018 Å
• b: 13.93535 ± 0.00018 Å
• c: 13.1629 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2556.16 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 82
• Hermann-Mauguin space group symbol: I -4
• Hall space group symbol: I -4
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1256
• Weighted residual factors for all reflections included in the refinement: 0.136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes