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Information card for entry 7156078
Preview
| Coordinates | 7156078.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C12 H16 N2 O8 S |
|---|---|
| Calculated formula | C12 H16 N2 O8 S |
| Title of publication | Novel conformationally constrained 2'-C-methylribonucleosides: synthesis and incorporation into oligonucleotides. |
| Authors of publication | Vejlegaard, Kim; Wegeberg, Christina; McKee, Vickie; Wengel, Jesper |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2018 |
| Journal volume | 16 |
| Journal issue | 8 |
| Pages of publication | 1312 - 1321 |
| a | 9.0606 ± 0.0003 Å |
| b | 10.3676 ± 0.0002 Å |
| c | 16.4849 ± 0.0004 Å |
| α | 82.4953 ± 0.0019° |
| β | 85.481 ± 0.002° |
| γ | 74.878 ± 0.002° |
| Cell volume | 1480.49 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 0.14 K |
| Number of distinct elements | 5 |
| Space group number | 1 |
| Hermann-Mauguin space group symbol | P 1 |
| Hall space group symbol | P 1 |
| Residual factor for all reflections | 0.0606 |
| Residual factor for significantly intense reflections | 0.0541 |
| Weighted residual factors for significantly intense reflections | 0.1383 |
| Weighted residual factors for all reflections included in the refinement | 0.1461 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301861 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/15/ Each referenced PubChem compound corresponds to the full crystal structure. |
7156078.cif |
| 230648 | 2019-11-17 | cif/ Updating files of 7156077, 7156078 Original log message: Adding full bibliography for 7156077--7156078.cif. |
7156078.cif |
| 205626 | 2018-01-25 | cif/ Adding structures of 7156077, 7156078 via cif-deposit CGI script. |
7156078.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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Users of the data should acknowledge the original authors of the
structural data.