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Information card for entry 2312864
Preview
| Coordinates | 2312864.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | DL-Arginine monohydrate |
|---|---|
| Chemical name | DL-Arginine monohydrate |
| Formula | C6 H16 N4 O3 |
| Calculated formula | C6 H16 N4 O3 |
| Title of publication | Structure of L-arginine and detection of trace DL-arginine by 3D ED. |
| Authors of publication | Khakurel, Krishna P.; Mahmoudi, Sohail |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2025 |
| Journal volume | 81 |
| Journal issue | 7 |
| a | 11.718 ± 0.002 Å |
| b | 10.095 ± 0.002 Å |
| c | 16.294 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1927.5 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.2077 |
| Residual factor for significantly intense reflections | 0.1849 |
| Weighted residual factors for significantly intense reflections | 0.4418 |
| Weighted residual factors for all reflections included in the refinement | 0.4576 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.154 |
| Diffraction radiation wavelength | 0.02508 Å |
| Diffraction radiation type | electron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 300205 (current) | 2025-06-26 | cif/ Adding structures of 2312863, 2312864 via cif-deposit CGI script. |
2312864.cif |
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