Information card for entry 2218385

Structure parameters

• Chemical name: <i>catena</i>-Poly[[bromidocopper(I)]-μ-η^2^,σ^1^-3-(2-allyl-2<i>H</i>- tetrazol-5-yl)pyridine]
• Formula: C9 H9 Br Cu N5
• Calculated formula: C9 H9 Br Cu N5
• SMILES: Br[Cu][n]1cccc(c1)c1nn(nn1)C[CH]1=[CH2][Cu]1(Br)[n]1cccc(c1)c1nn(nn1)CC=C
• Title of publication: <i>catena</i>-Poly[[bromidocopper(I)]-μ-η^2^,σ^1^-3-(2-allyl-2<i>H</i>-tetrazol-5-yl)pyridine]
• Authors of publication: Wang, Wei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 6
• Pages of publication: m759
• a: 7.4464 ± 0.0015 Å
• b: 7.7982 ± 0.0016 Å
• c: 9.94 ± 0.002 Å
• α: 80.15 ± 0.03°
• β: 76.02 ± 0.03°
• γ: 85.13 ± 0.03°
• Cell volume: 551.3 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0396
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0691
• Weighted residual factors for all reflections included in the refinement: 0.0716
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes