Information card for entry 7052935

Structure parameters

• Formula: Cu H4.8 N6.8 O1.2
• Calculated formula: Cu H4.8 N6.8 O1.2
• Title of publication: A 1D coordination polymer built on asymmetric μ1,1,3-azide bridge: from unusual topology to magnetic properties and Cu(ii)/Cu(i) redox reversibility
• Authors of publication: Tommasino, Jean-Bernard; Chastanet, Guillaume; Guennic, Boris Le; Robert, Vincent; Pilet, Guillaume
• Journal of publication: New Journal of Chemistry
• Year of publication: 2012
• Journal volume: 36
• Journal issue: 11
• Pages of publication: 2228
• a: 6.3808 ± 0.0003 Å
• b: 7.4452 ± 0.0003 Å
• c: 12.7044 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 603.54 ± 0.04 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0237
• Weighted residual factors for all reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.027
• Weighted residual factors for all reflections included in the refinement: 0.0256
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1142
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No