Information card for entry 4317081

Structure parameters

• Formula: C4 H12 Cu3 N20
• Calculated formula: C4 H12 Cu3 N20
• 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: 8.4648 ± 0.0003 Å
• b: 10.5388 ± 0.0005 Å
• c: 11.3126 ± 0.0006 Å
• α: 99.827 ± 0.002°
• β: 102.911 ± 0.002°
• γ: 113.017 ± 0.002°
• Cell volume: 867.1 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0642
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0832
• Weighted residual factors for all reflections included in the refinement: 0.0936
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No