Information card for entry 2018955

Structure parameters

• Common name: Cadaverinium dibromide
• Chemical name: Pentane-1,5-diaminium dibromide
• Formula: C5 H16 Br2 N2
• Calculated formula: C5.00033 H16 Br2 N2.00033
• Title of publication: Pentane-1,5-diaminium dibromide
• Authors of publication: Arderne, Charmaine
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: 526 - 528
• a: 4.5971 ± 0.0003 Å
• b: 15.4607 ± 0.0011 Å
• c: 41.389 ± 0.003 Å
• α: 90°
• β: 90.31 ± 0.005°
• γ: 90°
• Cell volume: 2941.7 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 4
• 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: 0.057
• Residual factor for significantly intense reflections: 0.0299
• Weighted residual factors for significantly intense reflections: 0.0471
• Weighted residual factors for all reflections included in the refinement: 0.0494
• Goodness-of-fit parameter for all reflections included in the refinement: 0.887
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes