Information card for entry 2225629

Structure parameters

• Chemical name: Diazidobis(propane-1,3-diamine)copper(II)
• Formula: C6 H20 Cu N10
• Calculated formula: C6 H20 Cu N10
• SMILES: C1CC[NH2][Cu]2([NH2]1)[NH2]CCC[NH2]2.[N-]=N#N.[N-]=N#N
• Title of publication: Diazidobis(propane-1,3-diamine)copper(II)
• Authors of publication: Khan, Islam Ullah; Ejaz; Şahin, Onur; Büyükgüngör, Orhan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: m434 - m435
• a: 6.6869 ± 0.0004 Å
• b: 6.7743 ± 0.0004 Å
• c: 8.2445 ± 0.0008 Å
• α: 93.296 ± 0.003°
• β: 98.306 ± 0.003°
• γ: 119.453 ± 0.002°
• Cell volume: 318.19 ± 0.04 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.0223
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0615
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes