Information card for entry 7720414

Structure parameters

• Formula: C19 H22 N8 O6
• Calculated formula: C19 H22 N8 O6
• Title of publication: Fused pyrazolo[3,4-<i>d</i>] pyrimidine nitrogen-rich salts with balanced energetic performance.
• Authors of publication: Nehe, Sagar; Ghule, Vikas D.; Dharavath, Srinivas
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2026
• Journal volume: 55
• Journal issue: 5
• Pages of publication: 2025 - 2029
• a: 14.81 ± 0.004 Å
• b: 18.242 ± 0.005 Å
• c: 8.351 ± 0.002 Å
• α: 90°
• β: 105.38 ± 0.007°
• γ: 90°
• Cell volume: 2175.3 ± 1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0777
• Residual factor for significantly intense reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.1861
• Weighted residual factors for all reflections included in the refinement: 0.1891
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0475
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No