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Information card for entry 4316408
Preview
| Coordinates | 4316408.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Chlorido-(hapta^6^-p-cymene)-{N-[(methoxycarbonyl)methyl]- -3-hydroxy-2-(1H)-pyridone-ruthenium(II) |
|---|---|
| Formula | C18 H22 Cl N O4 Ru |
| Calculated formula | C18 H22 Cl N O4 Ru |
| SMILES | [Ru]123456(Cl)(Oc7c(=[O]1)n(ccc7)CC(=O)OC)[c]1([cH]2[cH]3[c]4([cH]5[cH]61)C(C)C)C |
| Title of publication | Is the Reactivity of M(II)-Arene Complexes of 3-Hydroxy-2(1H)-pyridones to Biomolecules the Anticancer Activity Determining Parameter? |
| Authors of publication | Muhammad Hanif; Helena Henke; Samuel M. Meier; Sanela Martic; Mahmoud Labib; Wolfgang Kandioller; Michael A. Jakupec; Vladimir B. Arion; Heinz-Bernhard Kraatz; Bernhard K. Keppler; Christian G. Hartinger |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2010 |
| Journal volume | 49 |
| Pages of publication | 7953 - 7963 |
| a | 9.4338 ± 0.0004 Å |
| b | 10.0892 ± 0.0004 Å |
| c | 10.2654 ± 0.0005 Å |
| α | 79.995 ± 0.003° |
| β | 85.337 ± 0.003° |
| γ | 73.545 ± 0.002° |
| Cell volume | 922.26 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0546 |
| Residual factor for significantly intense reflections | 0.0356 |
| Weighted residual factors for significantly intense reflections | 0.0734 |
| Weighted residual factors for all reflections included in the refinement | 0.0802 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179244 (current) | 2016-03-23 | cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/64. |
4316408.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4316408.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4316408.cif |
| 9604 | 2011-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 4316408 via cif-deposit CGI script. |
4316408.cif |
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