Information card for entry 7060626

Structure parameters

• Common name: aqua tetrakis(1-cyclopentyl-5H-tetrazole) copper(II) diperchlorate
• Chemical name: aqua tetrakis(1-cyclopentyl-5H-tetrazole) copper(II) diperchlorate
• Formula: C48 H84 Cl4 Cu2 N32 O18
• Calculated formula: C48 H84 Cl4 Cu2 N32 O18
• Title of publication: Tailoring the properties of 3d transition metal complexes with different N-cycloalkyl-substituted tetrazoles
• Authors of publication: Braun, Vanessa; Wurzenberger, Maximilian H. H.; Weippert, Valentin; Stierstorfer, Jörg
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 25
• Pages of publication: 11042 - 11050
• a: 11.0187 ± 0.0005 Å
• b: 12.6481 ± 0.0008 Å
• c: 13.4478 ± 0.0008 Å
• α: 86.257 ± 0.005°
• β: 73.006 ± 0.005°
• γ: 82.596 ± 0.005°
• Cell volume: 1776.63 ± 0.18 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 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: 0.0772
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1171
• Weighted residual factors for all reflections included in the refinement: 0.1416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No