Information card for entry 2001821

Structure parameters

• Chemical name: Isopropylammonium-dihydrogen-monophosphate
• Formula: C3 H12 N O4 P
• Calculated formula: C3 H12 N O4 P
• Title of publication: Isopropylammonium dihydrogenmonophosphate and isopropylammonium monohydrogenphosphite
• Authors of publication: Averbuch-Pouchot, M.-T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 4
• Pages of publication: 813 - 815
• a: 5.769 ± 0.002 Å
• b: 15.39 ± 0.01 Å
• c: 8.504 ± 0.003 Å
• α: 90°
• β: 109.43 ± 0.03°
• γ: 90°
• Cell volume: 712 ± 0.6 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 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: 0.048
• Residual factor for significantly intense reflections: 0.025
• Weighted residual factors for significantly intense reflections: 0.027
• Goodness-of-fit parameter for significantly intense reflections: 0.39
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No