Information card for entry 4304674

Structure parameters

• Formula: C4 H16 Cu3 N22
• Calculated formula: C4 H16 Cu3 N22
• SMILES: N#N=N[Cu]1([N]([Cu]([N]#N=N[Cu]23([NH2]CC[NH2]2)[NH2]CC[NH2]3)([N]1=N#N)N=N#N)=N#N)N=N#N
• Title of publication: Three New Cu-Azido Polymers and Their Systematic Interconversion: Role of the Amount of the Blocking Amine on the Structural Diversity and Magnetic Behavior
• Authors of publication: Kartik Chandra Mondal; Partha Sarathi Mukherjee
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 4215 - 4225
• a: 8.186 ± 0.005 Å
• b: 14.187 ± 0.008 Å
• c: 16.577 ± 0.01 Å
• α: 90°
• β: 98.196 ± 0.01°
• γ: 90°
• Cell volume: 1906 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• 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: 0.0879
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1618
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No