Information card for entry 7056865

Structure parameters

• Common name: [Cu2(N3)3(Et2,Me-en)2]n(ClO4)n
• Formula: C14 H36 Cl Cu2 N13 O4
• Calculated formula: C14 H36 Cl Cu2 N13 O4
• Title of publication: Structure, magnetic properties and DFT calculations of azido-copper(ii) complexes with different azido-bonding, nuclearity and dimensionality
• Authors of publication: Massoud, Salah S.; Henary, Maher M.; Maxwell, Lindley; Martín, Alejandro; Ruiz, Eliseo; Vicente, Ramon; Fischer, Roland C.; Mautner, Franz A.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 4
• Pages of publication: 2627
• a: 7.8921 ± 0.0009 Å
• b: 12.8529 ± 0.0012 Å
• c: 13.2899 ± 0.0014 Å
• α: 70.941 ± 0.013°
• β: 82.294 ± 0.014°
• γ: 82.146 ± 0.014°
• Cell volume: 1256.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0437
• Residual factor for significantly intense reflections: 0.0406
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No