Information card for entry 2217596

Structure parameters

• Chemical name: Morpholinium perchlorate
• Formula: C4 H10 Cl N O5
• Calculated formula: C4 H10 Cl N O5
• SMILES: Cl(=O)(=O)(=O)[O-].O1CC[NH2+]CC1
• Title of publication: Morpholinium perchlorate
• Authors of publication: Grigoriev, Mikhail S.; German, Konstantin E.; Maruk, Alesia Ya.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 2
• Pages of publication: o390 - o390
• a: 8.1515 ± 0.0003 Å
• b: 9.5435 ± 0.0004 Å
• c: 28.9022 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2248.41 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0297
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0599
• Weighted residual factors for all reflections included in the refinement: 0.0618
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes