Information card for entry 2214040

Structure parameters

• Chemical name: Diisopropylammonium perchlorate
• Formula: C6 H16 Cl N O4
• Calculated formula: C6 H16 Cl N O4
• SMILES: Cl(=O)(=O)(=O)[O-].[NH2+](C(C)C)C(C)C
• Title of publication: Diisopropylammonium perchlorate at 263 K
• Authors of publication: Bajorat, Sara; Guido J. Reiß
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: o3144 - o3144
• a: 17.7018 ± 0.0018 Å
• b: 8.2468 ± 0.0007 Å
• c: 16.0601 ± 0.0016 Å
• α: 90°
• β: 116.334 ± 0.011°
• γ: 90°
• Cell volume: 2101.2 ± 0.4 ų
• Cell temperature: 263 ± 2 K
• Ambient diffraction temperature: 263 ± 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: 0.1004
• Residual factor for significantly intense reflections: 0.0436
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 0.961
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes