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Information card for entry 7205560
Preview
| Coordinates | 7205560.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H16 Ru |
|---|---|
| Calculated formula | C13 H16 Ru |
| SMILES | [Ru]12345678([cH]9[c]5([cH]4[cH]3[cH]2[cH]19)C)[CH]1=[CH]6CC[CH]7=[CH]81 |
| Title of publication | Methylated [(arene)(1,3-cyclohexadiene)Ru(0)] complexes as low-melting MOCVD precursor complexes with a controlled follow-up chemistry of the ligands |
| Authors of publication | Jipa, Ilona; Danova, Katya; Popovska, Nadejda; Siddiqi, M. Aslam; Siddiqui, Rehan A.; Atakan, Burak; Cremer, Till; Maier, Florian; Marbach, Hubertus; Steinrück, Hans-Peter; Heinemann, Frank W.; Zenneck, Ulrich |
| Journal of publication | Journal of Materials Chemistry |
| Year of publication | 2011 |
| Journal volume | 21 |
| Journal issue | 9 |
| Pages of publication | 3014 |
| a | 7.6694 ± 0.0004 Å |
| b | 8.274 ± 0.0004 Å |
| c | 8.5494 ± 0.0002 Å |
| α | 91.821 ± 0.003° |
| β | 108.474 ± 0.004° |
| γ | 93.874 ± 0.003° |
| Cell volume | 512.57 ± 0.04 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0293 |
| Residual factor for significantly intense reflections | 0.0231 |
| Weighted residual factors for significantly intense reflections | 0.05 |
| Weighted residual factors for all reflections included in the refinement | 0.0514 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.091 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
7205560.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205560.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205560.cif |
| 14937 | 2011-03-12 | ../uploads/cif-deposit/cod/cif Adding structures of 7205559, 7205560, 7205561 via cif-deposit CGI script. |
7205560.cif |
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Users of the data should acknowledge the original authors of the
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