Information card for entry 7057987

Structure parameters

• Common name: diaqua tetrakis(2-methyl-5H-tetrazolyl) copper(II) diperchlorate
• Chemical name: diaqua tetrakis(2-methyl-5H-tetrazolyl) copper(II) diperchlorate
• Formula: C8 H24 Cl2 Cu N20 O10
• Calculated formula: C8 H24 Cl2 Cu N20 O10
• Title of publication: 2-Methyl-substituted monotetrazoles in copper(ii) perchlorate complexes: manipulating coordination chemistry and derived energetic properties
• Authors of publication: Zeisel, Lukas; Szimhardt, Norbert; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Stierstorfer, Jörg
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 2
• Pages of publication: 609
• a: 7.8894 ± 0.0007 Å
• b: 19.915 ± 0.0015 Å
• c: 8.3691 ± 0.0006 Å
• α: 90°
• β: 101.004 ± 0.008°
• γ: 90°
• Cell volume: 1290.75 ± 0.18 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.062
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No