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Information card for entry 2312762
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| Coordinates | 2312762.cif |
|---|---|
| Structure factors | 2312762.hkl |
| Original IUCr paper | HTML |
| Chemical name | Tris(2'-deoxy-6-thioguanosine)nickel(II) dinitrate dihydrate |
|---|---|
| Formula | C30 H43 N17 Ni O17 S3 |
| Calculated formula | C30 H39 N17 Ni O17 S3 |
| Title of publication | Synthesis and crystal structure of a nickel(II) 2'-deoxy-6-thioguanosine nitrate complex. |
| Authors of publication | Hribesh, Samira O.; Clegg, William; Harrington, Ross W.; Houlton, Andrew; Pike, Andrew R. |
| Journal of publication | Acta crystallographica. Section C, Structural chemistry |
| Year of publication | 2025 |
| Journal volume | 81 |
| Journal issue | 3 |
| a | 24.185 ± 0.004 Å |
| b | 24.185 ± 0.004 Å |
| c | 6.6341 ± 0.001 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 3360.5 ± 0.9 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 143 |
| Hermann-Mauguin space group symbol | P 3 |
| Hall space group symbol | P 3 |
| Residual factor for all reflections | 0.0693 |
| Residual factor for significantly intense reflections | 0.056 |
| Weighted residual factors for significantly intense reflections | 0.1493 |
| Weighted residual factors for all reflections included in the refinement | 0.1566 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.6889 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297833 (current) | 2025-02-22 | cif/ hkl/ Adding structures of 2312762 via cif-deposit CGI script. |
2312762.cif 2312762.hkl |
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