Information card for entry 7135165

Structure parameters

• Formula: C H N O
• Calculated formula: C2.43478 H1.91304 N0.173913 O0.347826
• Title of publication: Leveraging cascade annulation of 2-alkynylcyclopropanes with substituted azides to access fused N-heterocyclic scaffolds
• Authors of publication: Saikia, Anil Kumar; Arandhara, Pallav Jyoti; Chutia, Archana
• Journal of publication: Chemical Communications
• Year of publication: 2025
• a: 9.7302 ± 0.0007 Å
• b: 10.877 ± 0.0008 Å
• c: 11.3278 ± 0.0008 Å
• α: 108.364 ± 0.002°
• β: 92.134 ± 0.002°
• γ: 90.464 ± 0.002°
• Cell volume: 1136.79 ± 0.14 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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: 0.0678
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.1754
• Weighted residual factors for all reflections included in the refinement: 0.1962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.419
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No