Information card for entry 4131934

Structure parameters

• Common name: tris(ditetrazolylpropyl) copper(II) chlorate
• Chemical name: tris(ditetrazolylpropyl) copper(II) chlorate'
• Formula: C15 H24 Cl2 Cu N24 O6
• Calculated formula: C15 H24 Cl2 Cu N24 O6
• Title of publication: Copper(II) Chlorate Complexes: The Renaissance of a Forgotten and Misjudged Energetic Anion.
• Authors of publication: Wurzenberger, Maximilian H. H.; Szimhardt, Norbert; Stierstorfer, Jörg
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• Journal volume: 140
• Journal issue: 9
• Pages of publication: 3206 - 3209
• a: 10.9642 ± 0.0002 Å
• b: 10.9642 ± 0.0002 Å
• c: 14.3772 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1496.78 ± 0.06 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0375
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0818
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No