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Information card for entry 2003648
Preview
| Coordinates | 2003648.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | 2',3'-dideoxy-3'-C-2'-N-[N(R)-methyl-5-(R)-ethoxycarbonyl-1,2-isoxazolidine] ribothymidine |
|---|---|
| Formula | C15 H21 N3 O7 |
| Calculated formula | C15 H21 N3 O7 |
| Title of publication | 2',3'-Dideoxy-3'-<i>C</i>,2'-<i>N</i>-[(3<i>R</i>,5<i>R</i>)-5-ethoxycarbonyl-2-methyl-1,2-isoxazolidine]ribothymidine |
| Authors of publication | Burkhart, B. M.; Papchikhin, A.; Chattopadhyaya, J.; Sundaralingam, M. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1995 |
| Journal volume | 51 |
| Journal issue | 7 |
| Pages of publication | 1462 - 1464 |
| a | 5.502 ± 0.001 Å |
| b | 15.384 ± 0.001 Å |
| c | 9.918 ± 0.002 Å |
| α | 90° |
| β | 93.43 ± 0.02° |
| γ | 90° |
| Cell volume | 838 ± 0.2 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.0762 |
| Residual factor for significantly intense reflections | 0.0369 |
| Weighted residual factors for all reflections | 0.1311 |
| Weighted residual factors for significantly intense reflections | 0.0834 |
| Goodness-of-fit parameter for all reflections | 1.05 |
| Goodness-of-fit parameter for significantly intense reflections | 1.091 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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