Information card for entry 2232769

Structure parameters

• Chemical name: <i>catena</i>-Poly[[diacetonitrilecopper(I)]-μ-dicyanamido]
• Formula: C6 H6 Cu N5
• Calculated formula: C6 H6 Cu N5
• SMILES: [Cu]([N]#CC)([N]#CC)([N]#CN=C=N[Cu]([N]#CC)[N]#CC)N=C=NC#N
• Title of publication: <i>catena</i>-Poly[[diacetonitrilecopper(I)]-μ-dicyanamido]
• Authors of publication: Oelkers, Benjamin; Stricker, Marion; Sundermeyer, Jörg
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1784
• a: 7.5222 ± 0.0005 Å
• b: 10.5307 ± 0.0011 Å
• c: 5.5378 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 438.67 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n :2
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0656
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes