Information card for entry 7058153

Structure parameters

• Formula: C21 H21 N5
• Calculated formula: C21 H21 N5
• Title of publication: Four-component, three-step cascade reaction: an effective synthesis of indazole-fused triazolo[5,1-c]quinoxalines
• Authors of publication: Shiva Kumar, K.; Naikawadi, Praveen Kumar; Rajesham, Bandari; Rambabu, D.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 11
• Pages of publication: 4333
• a: 12.2671 ± 0.0005 Å
• b: 18.157 ± 0.0008 Å
• c: 15.9123 ± 0.0007 Å
• α: 90°
• β: 96.146 ± 0.002°
• γ: 90°
• Cell volume: 3523.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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: 0.0842
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1532
• Weighted residual factors for all reflections included in the refinement: 0.1666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No