Information card for entry 7238264

Structure parameters

• Formula: C3 H13 N O7 P2
• Calculated formula: C3 H13 N O7 P2
• Title of publication: Hydrogen-bonded assembly of aminophosphonic anions: different 1D, 2D and 3D supramolecular architectures
• Authors of publication: Chen, Shuo-ping; Zhang, Yu-qin; Hu, Le; He, Hong-zhen; Yuan, Liang-jie
• Journal of publication: CrystEngComm
• Year of publication: 2010
• Journal volume: 12
• Journal issue: 10
• Pages of publication: 3327
• a: 10.9976 ± 0.0009 Å
• b: 6.9889 ± 0.0006 Å
• c: 12.5997 ± 0.001 Å
• α: 90°
• β: 113.564 ± 0.001°
• γ: 90°
• Cell volume: 887.67 ± 0.13 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0322
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections included in the refinement: 0.0879
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No