Information card for entry 2004685

Structure parameters

• Formula: C2 H8 N6 O3
• Calculated formula: C2 H8 N6 O3
• Title of publication: Energetic Materials: the Biguanidium Nitrates
• Authors of publication: Martin, A.; Pinkerton, A. A.; Schiemann, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 4
• Pages of publication: 966 - 970
• a: 6.959 ± 0.001 Å
• b: 10.778 ± 0.002 Å
• c: 9.489 ± 0.002 Å
• α: 90°
• β: 109.28 ± 0.02°
• γ: 90°
• Cell volume: 671.8 ± 0.2 ų
• Cell temperature: 193 K
• Ambient diffraction temperature: 193 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.046
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.048
• Goodness-of-fit parameter for significantly intense reflections: 1.42
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No