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Information card for entry 2000651
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| Coordinates | 2000651.cif |
|---|---|
| Original IUCr paper | HTML |
| Common name | meropenem |
|---|---|
| Chemical name | (1R,5S,6S)-2-[(3S,5S)-5-Dimethylaminocarbonylpyrrolidin-3-ylthio]- 6-[(R)-1-hydroxyethyl]-1-methylcarbapen-2-em-3-carboxylate trihydrate |
| Formula | C17 H31 N3 O8 S |
| Calculated formula | C17 H31 N3 O8 S |
| Title of publication | Structure of a novel carbapenem antibiotic, meropenem |
| Authors of publication | Yanagi, K.; Takeuchi, Y.; Sunagawa, M. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1992 |
| Journal volume | 48 |
| Journal issue | 9 |
| Pages of publication | 1737 - 1739 |
| a | 9.279 ± 0.001 Å |
| b | 14.035 ± 0.001 Å |
| c | 9.123 ± 0.001 Å |
| α | 90° |
| β | 117.37 ± 0.01° |
| γ | 90° |
| Cell volume | 1055.1 ± 0.2 Å3 |
| Cell temperature | 295 K |
| Ambient diffraction temperature | 295 K |
| Number of distinct elements | 5 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.036 |
| Residual factor for significantly intense reflections | 0.034 |
| Weighted residual factors for significantly intense reflections | 0.046 |
| Goodness-of-fit parameter for significantly intense reflections | 1.82 |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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