Information card for entry 7235825

Structure parameters

• Common name: 4,4',5,5'-Tetraamino-3,3'-bi-1,2,4-triazolium bisdinitramide
• Chemical name: 4,4',5,5'-Tetraamino-3,3'-bi-1,2,4-triazolium bisdinitramide
• Formula: C4 H10 N16 O8
• Calculated formula: C4 H10 N16 O8
• Title of publication: Thermal stabilization of energetic materials by the aromatic nitrogen-rich 4,4′,5,5′-tetraamino-3,3′-bi-1,2,4-triazolium cation
• Authors of publication: Klapötke, Thomas M.; Schmid, Philipp. C.; Schnell, Simon; Stierstorfer, Jörg
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2015
• Journal volume: 3
• Journal issue: 6
• Pages of publication: 2658
• a: 6.5046 ± 0.0009 Å
• b: 7.701 ± 0.0013 Å
• c: 8.4831 ± 0.0013 Å
• α: 97.897 ± 0.013°
• β: 107.262 ± 0.013°
• γ: 111.478 ± 0.014°
• Cell volume: 362.85 ± 0.12 ų
• Cell temperature: 100 ± 2 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: 0.0486
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No