Information card for entry 7000349

Structure parameters

• Common name: azidoformamidinium dinitramide monohydrate
• Chemical name: azidoformamidinium dinitramide monohydrate
• Formula: C H6 N8 O5
• Calculated formula: C H6 N8 O5
• SMILES: C(N=N#N)(=[NH2+])N.O=N([O-])=NN(=O)=O.O
• Title of publication: Azidoformamidinium and 5-aminotetrazolium dinitramide—two highly energetic isomers with a balanced oxygen content
• Authors of publication: Klapötke, Thomas M.; Stierstorfer, Jörg
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• a: 7.2806 ± 0.0008 Å
• b: 5.9376 ± 0.0007 Å
• c: 9.8324 ± 0.0005 Å
• α: 90°
• β: 110.609 ± 0.007°
• γ: 90°
• Cell volume: 397.85 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 4
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.052
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.0911
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No