Information card for entry 2008245

Structure parameters

• Chemical name: Bis(méta-anisidinium) Dihydrogénodiphosphate
• Formula: C14 H22 N2 O9 P2
• Calculated formula: C14 H22 N2 O9 P2
• SMILES: COc1cc(ccc1)[NH3+].OP(=O)([O-])OP(=O)(O)[O-].c1(cc(ccc1)OC)[NH3+]
• Title of publication: Bis(<i>m</i>-anisidinium) dihydrogénodiphosphate
• Authors of publication: Ould Abdellahi, Mohamed; Ben Amor, Fatma; Driss, Ahmed; Jouini, Tahar
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 3
• Pages of publication: 474 - 476
• a: 29.501 ± 0.002 Å
• b: 8.5509 ± 0.0014 Å
• c: 7.963 ± 0.003 Å
• α: 90°
• β: 101.15 ± 0.02°
• γ: 90°
• Cell volume: 1970.8 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0899
• Residual factor for significantly intense reflections: 0.0516
• Weighted residual factors for all reflections: 0.1296
• Weighted residual factors for significantly intense reflections: 0.1107
• Goodness-of-fit parameter for all reflections: 1.058
• Goodness-of-fit parameter for significantly intense reflections: 1.145
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No