Information card for entry 7707752

Structure parameters

• Common name: 1-nitratoethyl-5H-tetrazole diazido copper(II)
• Chemical name: 1-nitratoethyl-5H-tetrazole diazido copper(II)
• Formula: C6 H10 Cu2 N22 O6
• Calculated formula: C6 H10 Cu2 N22 O6
• Title of publication: Nitratoethyl-5H-tetrazoles: improving the oxygen balance through application of organic nitrates in energetic coordination compounds.
• Authors of publication: Gruhne, Michael S.; Lenz, Tobias; Rösch, Markus; Lommel, Marcus; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M; Stierstorfer, Jörg
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 31
• Pages of publication: 10811 - 10825
• a: 6.2622 ± 0.0004 Å
• b: 10.5985 ± 0.0008 Å
• c: 15.9381 ± 0.0014 Å
• α: 102.119 ± 0.003°
• β: 96.226 ± 0.003°
• γ: 91.774 ± 0.003°
• Cell volume: 1026.56 ± 0.14 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0608
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0728
• Weighted residual factors for all reflections included in the refinement: 0.0789
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No