Information card for entry 1556256

Structure parameters

• Formula: C20 H18 N2 O
• Calculated formula: C20 H18 N2 O
• SMILES: o1c2nc3ccccc3nc2cc1c1ccc(cc1)C(C)(C)C
• Title of publication: Copper(II) catalyzed expeditious synthesis of furoquinoxalines through a one-pot three-component coupling strategy.
• Authors of publication: Naresh, Gunaganti; Kant, Ruchir; Narender, Tadigoppula
• Journal of publication: Organic letters
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 17
• Pages of publication: 4528 - 4531
• a: 12.413 ± 0.005 Å
• b: 9.758 ± 0.004 Å
• c: 13.526 ± 0.006 Å
• α: 90°
• β: 95.449 ± 0.007°
• γ: 90°
• Cell volume: 1630.9 ± 1.2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0702
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1737
• Weighted residual factors for all reflections included in the refinement: 0.1854
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No