Information card for entry 4317079

Structure parameters

• Formula: C6 H14 Cu3 N20 O
• Calculated formula: C6 H14 Cu3 N20 O
• Title of publication: A Series of CuII-Azide Polymers of Cu6 Building Units and the Role of Chelating Diamine in Controlling their Dimensionality: Synthesis, Structures, and Magnetic Behavior
• Authors of publication: Sandip Mukherjee; Partha Sarathi Mukherjee
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 10658 - 10667
• a: 8.501 ± 0.0003 Å
• b: 12.9761 ± 0.0004 Å
• c: 16.8519 ± 0.0005 Å
• α: 90°
• β: 97.538 ± 0.002°
• γ: 90°
• Cell volume: 1842.87 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0352
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0564
• Weighted residual factors for all reflections included in the refinement: 0.0595
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No