Information card for entry 2221472

Structure parameters

• Common name: (2,5-DBrPyr)
• Chemical name: 2,5-dibromopyridine
• Formula: C5 H3 Br2 N
• Calculated formula: C5 H3 Br2 N
• SMILES: Brc1ccc(cn1)Br
• Title of publication: 2,5-Dibromopyridine
• Authors of publication: Al-Far, Rawhi H.; Ali, Basem Fares
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 4
• Pages of publication: o843
• a: 6.1063 ± 0.0004 Å
• b: 6.5442 ± 0.0004 Å
• c: 15.8196 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 632.16 ± 0.07 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 4
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0244
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0526
• Weighted residual factors for all reflections included in the refinement: 0.0543
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes