Information card for entry 1563898

Structure parameters

• Formula: C6 H20 Cu7 N46
• Calculated formula: C6 H20 Cu7 N46
• Title of publication: Synthesis, structures and magnetic studies of new copper-azides
• Authors of publication: Mistry, Subhradeep; Natarajan, Srinivasan
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2018
• Journal volume: 483
• Pages of publication: 26 - 38
• a: 8.4313 ± 0.0005 Å
• b: 9.711 ± 0.0006 Å
• c: 11.9231 ± 0.0008 Å
• α: 102 ± 0.003°
• β: 96.837 ± 0.003°
• γ: 109.054 ± 0.003°
• Cell volume: 883.93 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0501
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0852
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No