Information card for entry 2237388

Structure parameters

• Chemical name: 2-Chlorobenzene-1,4-diaminium bis(dihydrogenphosphate)
• Formula: C6 H13 Cl N2 O8 P2
• Calculated formula: C6 H13 Cl N2 O8 P2
• Title of publication: 2-Chlorobenzene-1,4-diaminium bis(dihydrogenphosphate)
• Authors of publication: Mrad, Mohamed Lahbib; Zeller, Matthias; Rzaigui, Mohamed; Ben Nasr, Cherif
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 2
• Pages of publication: o159 - o160
• a: 7.0084 ± 0.0008 Å
• b: 7.9404 ± 0.0009 Å
• c: 23.064 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1283.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0251
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.064
• Weighted residual factors for all reflections included in the refinement: 0.0643
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes