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Information card for entry 2013059
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| Coordinates | 2013059.cif |
|---|---|
| Structure factors | 2013059.hkl |
| Original IUCr paper | HTML |
| Chemical name | Ammonium 4-nitrophenylarsonate |
|---|---|
| Formula | C6 H9 As N2 O5 |
| Calculated formula | C6 H9 As N2 O5 |
| SMILES | [As](=O)([O-])(O)c1ccc(N(=O)=O)cc1.[NH4+] |
| Title of publication | Ammonium 4-nitrophenylarsonate |
| Authors of publication | Yang, Jin; Ma, Jian-Fang; Liu, Ying-Chun; Zheng, Guo-Li; Li, Li; Liu, Jing-Fu; Hu, Ning-Hai; Jia, Heng-Qing |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2002 |
| Journal volume | 58 |
| Journal issue | 12 |
| Pages of publication | m613 - m614 |
| a | 11.67 ± 0.003 Å |
| b | 6.5073 ± 0.0016 Å |
| c | 12.693 ± 0.003 Å |
| α | 90° |
| β | 107.975 ± 0.018° |
| γ | 90° |
| Cell volume | 916.9 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.039 |
| Residual factor for significantly intense reflections | 0.03 |
| Weighted residual factors for significantly intense reflections | 0.075 |
| Weighted residual factors for all reflections included in the refinement | 0.077 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.979 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
Version history
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