Information card for entry 7710728

Structure parameters

• Common name: 4-Methyl-2,5-aminotetrazolium iodide
• Chemical name: 4-Methyl-2,5-aminotetrazolium iodide
• Formula: C2 H7 I N6
• Calculated formula: C2 H7 I N6
• Title of publication: Chemistry of 2,5-diaminotetrazole.
• Authors of publication: Bauer, Josh; Benz, Maximilian; Klapötke, Thomas M; Stierstorfer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2022
• a: 7.076 ± 0.0003 Å
• b: 11.2519 ± 0.0005 Å
• c: 9.718 ± 0.0004 Å
• α: 90°
• β: 102.229 ± 0.004°
• γ: 90°
• Cell volume: 756.18 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.026
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.0482
• Weighted residual factors for all reflections included in the refinement: 0.0507
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No