Information card for entry 7719029

Structure parameters

• Common name: diaqua di(1-amino-5-nitriminotetrazolato) copper(II)
• Chemical name: diaqua di(1-amino-5-nitriminotetrazolato) copper(II)
• Formula: C2 H8 Cu N14 O6
• Calculated formula: C2 H8 Cu N14 O6
• Title of publication: 1-Amino-5-nitriminotetrazolate as a promising anion in safe yet powerful energetic coordination compounds.
• Authors of publication: Benz, Maximilian; Endraß, Simon M J; Klapötke, Thomas M; Stierstorfer, Jörg; Strey, Sadiq
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 15
• Pages of publication: 6156 - 6166
• a: 5.605 ± 0.003 Å
• b: 9.087 ± 0.006 Å
• c: 11.608 ± 0.007 Å
• α: 90°
• β: 95.79 ± 0.012°
• γ: 90°
• Cell volume: 588.2 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0313
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0669
• Weighted residual factors for all reflections included in the refinement: 0.069
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No