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Information card for entry 2300371
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| Coordinates | 2300371.cif |
|---|---|
| Structure factors | 2300371.hkl |
| Original paper (by DOI) | HTML |
| Common name | cytidine |
|---|---|
| Formula | C9 H13 N3 O5 |
| Calculated formula | C9 H13 N3 O5 |
| SMILES | OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1ccc(nc1=O)N |
| Title of publication | <i>Masquerade</i>: removing non-sample scattering from integrated reflection intensities |
| Authors of publication | Coome, J. A.; Goeta, A. E.; Howard, J. A. K.; Probert, M. R. |
| Journal of publication | Journal of Applied Crystallography |
| Year of publication | 2012 |
| Journal volume | 45 |
| Journal issue | 2 |
| Pages of publication | 292 - 298 |
| a | 5.0784 ± 0.0003 Å |
| b | 13.9046 ± 0.001 Å |
| c | 14.6992 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1037.96 ± 0.12 Å3 |
| Cell temperature | 2 ± 0.1 K |
| Ambient diffraction temperature | 2 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0721 |
| Residual factor for significantly intense reflections | 0.0457 |
| Weighted residual factors for significantly intense reflections | 0.0822 |
| Weighted residual factors for all reflections included in the refinement | 0.0896 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181326 (current) | 2016-04-03 | hkl/2/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/30. |
2300371.cif 2300371.hkl |
| 176809 | 2016-02-21 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 2. |
2300371.cif 2300371.hkl |
| 120072 | 2014-07-11 | Adding DOIs to range 2 structures. | 2300371.cif 2300371.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2300371.cif 2300371.hkl |
| 66590 | 2012-09-11 | hkl/ Adding assigned .htl files for the most recent IUCr data depositions. |
2300371.cif 2300371.hkl |
| 55508 | 2012-05-05 | cif/ Adding structures of 2300371 via cif-deposit CGI script. |
2300371.cif |
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Users of the data should acknowledge the original authors of the
structural data.