Information card for entry 2214179

Structure parameters

• Common name: (1S,3R)-3-monoamino-1-camphoric acid nitrate
• Chemical name: (1<i>S</i>,3<i>R</i>)-1-Carboxy-2,2,3-trimethylcyclopentane-1-ammonium nitrate
• Formula: C9 H18 N2 O5
• Calculated formula: C9 H18 N2 O5
• SMILES: [C@H]1(C([C@](CC1)(C)[NH3+])(C)C)C(=O)O.N(=O)(=O)[O-]
• Title of publication: (1<i>S</i>,3<i>R</i>)-1-Carboxy-2,2,3-trimethylcyclopentane-1-ammonium nitrate
• Authors of publication: Qian, Hui-Fen; Huang, Wei; Liu, Jian-Lan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: o3070 - o3072
• a: 7.0696 ± 0.0019 Å
• b: 12.473 ± 0.003 Å
• c: 13.555 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1195.3 ± 0.6 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 4
• 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: 0.083
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.119
• Weighted residual factors for all reflections included in the refinement: 0.13
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes