Information card for entry 7237125

Structure parameters

• Common name: 1,2-ditetrazolylpropane copper(II) perchlorate
• Chemical name: 1,2-ditetrazolylpropane copper(II) perchlorate
• Formula: C30 H48 Cl4 Cu2 N48 O16
• Calculated formula: C30 H48 Cl4 Cu2 N48 O16
• Title of publication: Highly functional energetic complexes: stability tuning through coordination diversity of isomeric propyl-linked ditetrazoles
• Authors of publication: Szimhardt, Norbert; Wurzenberger, Maximilian H. H.; Klapötke, Thomas M.; Lechner, Jasmin T.; Reichherzer, Hannes; Unger, Cornelia C.; Stierstorfer, Jörg
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2018
• Journal volume: 6
• Journal issue: 15
• Pages of publication: 6565
• a: 13.226 ± 0.0006 Å
• b: 13.786 ± 0.0008 Å
• c: 20.222 ± 0.0008 Å
• α: 99.253 ± 0.004°
• β: 102.001 ± 0.004°
• γ: 114.596 ± 0.005°
• Cell volume: 3150 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0893
• Residual factor for significantly intense reflections: 0.0651
• Weighted residual factors for significantly intense reflections: 0.1665
• Weighted residual factors for all reflections included in the refinement: 0.186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No