Information card for entry 2202587

Structure parameters

• Chemical name: N,N'-Bis(aminopropyl)-1,4-benzylidenediammonium diperchlorate
• Formula: C14 H24 Cl2 N4 O8
• Calculated formula: C14 H24 Cl2 N4 O8
• SMILES: c1(/C=N/CCC[NH3+])ccc(cc1)/C=N/CCC[NH3+].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: <i>N,N</i>'-Bis(aminopropyl)-1,4-benzylidenediammonium diperchlorate
• Authors of publication: Yang, Shi-Ping; Chen, Hong-Mei; Znang, Fan; Yu, Xi-Bin; Weng, lin-Hong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: o1830 - o1831
• a: 13.358 ± 0.003 Å
• b: 7.864 ± 0.002 Å
• c: 9.313 ± 0.002 Å
• α: 90°
• β: 91.714 ± 0.003°
• γ: 90°
• Cell volume: 977.9 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0552
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.1384
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes