Information card for entry 7135794

Structure parameters

• Formula: C10 H13 N5 O3
• Calculated formula: C10 H13 N5 O3
• Title of publication: Can Cyclopropyl Rings Serve as Energetic Moieties? A Structural and Reactivity Perspective
• Authors of publication: Kukreja, Sonali; K, Anupama; Dharavath, Srinivas
• Journal of publication: Chemical Communications
• Year of publication: 2026
• a: 5.1034 ± 0.0002 Å
• b: 10.0245 ± 0.0005 Å
• c: 11.6245 ± 0.0005 Å
• α: 68.395 ± 0.001°
• β: 83.137 ± 0.002°
• γ: 82.244 ± 0.002°
• Cell volume: 546.28 ± 0.04 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0777
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1384
• Weighted residual factors for all reflections included in the refinement: 0.1594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No