Information card for entry 2211585

Structure parameters

• Chemical name: Poly[[(2-amino-5-bromopyridine-κN)copper(I)]-μ~3~-iodo]
• Formula: C5 H5 Br Cu I N2
• Calculated formula: C5 H5 Br Cu I N2
• SMILES: [Cu]12([n]3cc(Br)ccc3N)[I][Cu]([n]3cc(Br)ccc3N)[I]1[Cu]1([n]3cc(Br)ccc3N)[I]2[Cu]([I]1)[n]1cc(Br)ccc1N
• Title of publication: Poly[[(2-amino-5-bromopyridine-κ<i>N</i>)copper(I)]-μ~3~-iodo]
• Authors of publication: Aliakbar Dehno Khalaji; Mehdi Amirnasr; Jean-Claude Daran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3222 - m3224
• a: 8.7391 ± 0.0005 Å
• b: 4.2118 ± 0.0003 Å
• c: 21.8958 ± 0.0013 Å
• α: 90°
• β: 99.135 ± 0.005°
• γ: 90°
• Cell volume: 795.7 ± 0.09 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• 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: 0.0247
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0507
• Weighted residual factors for all reflections included in the refinement: 0.0522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes