Information card for entry 2229924

Structure parameters

• Common name: Putrescine diperchlorate
• Chemical name: Butane-1,4-diammonium bis(perchlorate)
• Formula: C4 H14 Cl2 N2 O8
• Calculated formula: C4 H14 Cl2 N2 O8
• SMILES: C(CCC[NH3+])[NH3+].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Butane-1,4-diammonium bis(perchlorate)
• Authors of publication: Arderne, Charmaine; Kruger, Gert J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 5
• Pages of publication: o1060
• a: 19.4755 ± 0.001 Å
• b: 5.621 ± 0.0003 Å
• c: 5.347 ± 0.0002 Å
• α: 90°
• β: 97.222 ± 0.003°
• γ: 90°
• Cell volume: 580.7 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0625
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for significantly intense reflections: 0.1498
• Weighted residual factors for all reflections included in the refinement: 0.1554
• 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