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Information card for entry 1551798
Preview
| Coordinates | 1551798.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | L-(S)-Tryptophane-D-(R)-Mandelate 1.5H2O |
|---|---|
| Formula | C19 H23 N2 O6.5 |
| Calculated formula | C19 H23 N2 O6.5 |
| Title of publication | Crystal Structure of L-(S)-Tryptophane D-(R)-mandelate 1.5H2O |
| Authors of publication | FUJII, Isao |
| Journal of publication | X-ray Structure Analysis Online |
| Year of publication | 2009 |
| Journal volume | 25 |
| Pages of publication | 35 |
| a | 32.997 ± 0.002 Å |
| b | 5.8823 ± 0.0008 Å |
| c | 9.8717 ± 0.0009 Å |
| α | 90° |
| β | 103.483 ± 0.006° |
| γ | 90° |
| Cell volume | 1863.3 ± 0.3 Å3 |
| Cell temperature | 297 K |
| Ambient diffraction temperature | 297 K |
| Number of distinct elements | 4 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for all reflections | 0.0368 |
| Residual factor for significantly intense reflections | 0.0346 |
| Weighted residual factors for significantly intense reflections | 0.0948 |
| Weighted residual factors for all reflections included in the refinement | 0.0971 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216410 (current) | 2019-06-20 | cif/ Adding structures of 1551798 via cif-deposit CGI script. |
1551798.cif |
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