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Information card for entry 4063379
Preview
| Coordinates | 4063379.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | {(hapto^6^-p-cymene)[N-(2-chloro-5,11-dihydroindolo[3,2-c]quinolin-6- ylidene)kappaN'-(1-kappaN-pyridin-2-yl-ethylidene)]azine chlorido- ruthenium(II)} chloride ethanol solvate |
|---|---|
| Formula | C34 H36 Cl3 N5 O Ru |
| Calculated formula | C34 H36 Cl3 N5 O Ru |
| SMILES | [Ru]123456(Cl)([N](N=C7Nc8c(c9[nH]c%10ccccc%10c79)cc(Cl)cc8)=C(c7[n]1cccc7)C)[c]1([cH]6[cH]5[c]4([cH]3[cH]21)C(C)C)C.[Cl-].OCC |
| Title of publication | Ruthenium- and Osmium-Arene Complexes of 2-Substituted Indolo[3,2-c]quinolines: Synthesis, Structure, Spectroscopic Properties, and Antiproliferative Activity |
| Authors of publication | Filak, Lukas K.; Mühlgassner, Gerhard; Bacher, Felix; Roller, Alexander; Galanski, Markus; Jakupec, Michael A.; Keppler, Bernhard K.; Arion, Vladimir B. |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 2 |
| Pages of publication | 273 - 283 |
| a | 10.735 ± 0.0004 Å |
| b | 12.0515 ± 0.0004 Å |
| c | 25.1678 ± 0.0009 Å |
| α | 90° |
| β | 94.293 ± 0.002° |
| γ | 90° |
| Cell volume | 3246.9 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0785 |
| Residual factor for significantly intense reflections | 0.0542 |
| Weighted residual factors for significantly intense reflections | 0.1462 |
| Weighted residual factors for all reflections included in the refinement | 0.1581 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178528 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/33. |
4063379.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4063379.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4063379.cif |
| 18121 | 2011-04-27 | ../uploads/cif-deposit/cod/cif Adding structures of 4063378, 4063379, 4063380, 4063381, 4063382, 4063383 via cif-deposit CGI script. |
4063379.cif |
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