Information card for entry 2016680

Structure parameters

• Chemical name: catena-poly[[dibromidocopper(II)]-μ~2~-4,4'-(<i>p</i>-phenylene)bipyridazine- κ^2^N^2^:N^2'^]
• Formula: C14 H10 Br2 Cu N4
• Calculated formula: C14 H10 Br2 Cu N4
• SMILES: Br[Cu](Br)[n]1nccc(c1)c1ccc(cc1)c1c[n](ncc1)[Cu](Br)(Br)[n]1nccc(c1)c1ccc(cc1)c1cnncc1
• Title of publication: Copper(II) bromide and copper(II) acetate complexes of 4,4'-(<i>p</i>-phenylene)bipyridazine
• Authors of publication: Degtyarenko, Anna S.; Solntsev, Pavlo V.; Rusanov, Eduard B.; Chernega, Alexander N.; Domasevitch, Konstantin V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: m254 - m258
• a: 4.1377 ± 0.0002 Å
• b: 12.5407 ± 0.0007 Å
• c: 13.5301 ± 0.0008 Å
• α: 90°
• β: 93.786 ± 0.004°
• γ: 90°
• Cell volume: 700.54 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.0474
• Residual factor for significantly intense reflections: 0.0311
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0695
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes