Information card for entry 7152045

Structure parameters

• Formula: C18 H13 F N2 O
• Calculated formula: C18 H13 F N2 O
• SMILES: Fc1cc2N(c3ccc(cc3)C)C(=O)c3n(c2cc1)ccc3
• Title of publication: One-pot synthesis of pyrrolo[1,2-a]quinoxalines.
• Authors of publication: Huang, Aiping; Liu, Feng; Zhan, Chunjing; Liu, Yanli; Ma, Chen
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2011
• Journal volume: 9
• Journal issue: 21
• Pages of publication: 7351 - 7357
• a: 8.023 Å
• b: 15.891 Å
• c: 22.67 Å
• α: 90°
• β: 97.96°
• γ: 90°
• Cell volume: 2862.43 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0772
• Residual factor for significantly intense reflections: 0.0495
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1443
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No