Information card for entry 2202215

Structure parameters

• Common name: L-argininium bis(dihydrogen phosphate)
• Chemical name: L-argininium bis(dihydrogen phosphate)
• Formula: C6 H20 N4 O10 P2
• Calculated formula: C6 H20 N4 O10 P2
• SMILES: P(=O)([O-])(O)O.P(=O)([O-])(O)O.OC(=O)[C@@H]([NH3+])CCCNC(=[NH2+])N
• Title of publication: <small>L</small>-Argininium bis(dihydrogen phosphate)
• Authors of publication: Reena Ittyachan; P. Sagayaraj; Babu Kothandapani
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 6
• Pages of publication: o886 - o888
• a: 6.991 ± 0.0002 Å
• b: 9.676 ± 0.0005 Å
• c: 21.735 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1470.26 ± 0.16 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0441
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1311
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1.272
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes