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Information card for entry 7700462
Preview
| Coordinates | 7700462.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | [(kN2-Pyridine)(1,3-dioxo-kO1-1,3-dihydro-2H-inden-2-ylidene)((2-(naphthalen-1-yl)methyl)amino)methanolato-kO2)](c6-p-cymene)ruthenium(II) |
|---|---|
| Formula | C36 H33 F6 N2 O3 P Ru |
| Calculated formula | C36 H33 F6 N2 O3 P Ru |
| Title of publication | Ruthenium-arene complexes bearing naphthyl-substituted 1,3-dioxoindan-2-carboxamides ligands for G-quadruplex DNA recognition. |
| Authors of publication | Hager, Laura A.; Mokesch, Stephan; Kieler, Claudia; Alonso-de Castro, Silvia; Baier, Dina; Roller, Alexander; Kandioller, Wolfgang; Keppler, Bernhard K.; Berger, Walter; Salassa, Luca; Terenzi, Alessio |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2019 |
| Journal volume | 48 |
| Journal issue | 32 |
| Pages of publication | 12040 - 12049 |
| a | 13.8315 ± 0.001 Å |
| b | 15.1456 ± 0.0007 Å |
| c | 16.7083 ± 0.0011 Å |
| α | 90° |
| β | 109.345 ± 0.002° |
| γ | 90° |
| Cell volume | 3302.5 ± 0.4 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0759 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.1083 |
| Weighted residual factors for all reflections included in the refinement | 0.124 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7700462.cif |
| 223910 | 2019-11-07 | cif/ Updating files of 7700460, 7700461, 7700462 Original log message: Adding full bibliography for 7700460--7700462.cif. |
7700462.cif |
| 216767 | 2019-07-05 | cif/ Adding structures of 7700460, 7700461, 7700462 via cif-deposit CGI script. |
7700462.cif |
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