Information card for entry 7246431

Structure parameters

• Formula: C4 H4 N2 O2
• Calculated formula: C4 H4 N2 O2
• Title of publication: Improving the stability of hydrazinium pentazolate through cocrystallization
• Authors of publication: Zhou, Jianxin; Li, Xinyi; Hou, Tianyang; Xu, Ze; Wang, Pengcheng; Lu, Ming; Xu, Yuangang
• Journal of publication: CrystEngComm
• Year of publication: 2023
• Journal volume: 25
• Journal issue: 14
• Pages of publication: 2027 - 2031
• a: 3.7348 ± 0.001 Å
• b: 11.013 ± 0.003 Å
• c: 5.7044 ± 0.0014 Å
• α: 90°
• β: 96.47 ± 0.01°
• γ: 90°
• Cell volume: 233.14 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0529
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0912
• Weighted residual factors for all reflections included in the refinement: 0.1011
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No