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Information card for entry 8103224
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| Coordinates | 8103224.cif |
|---|
| Chemical name | [(μ^^6^-p-Cymene)RuCl~2~(DMAP)](DMAP = N,N-Dimethylpyridin-4-amine) |
|---|---|
| Formula | C17 H24 Cl2 N2 Ru |
| Calculated formula | C17 H24 Cl2 N2 Ru |
| SMILES | [Ru]12345(Cl)(Cl)([n]6ccc(N(C)C)cc6)[c]6(C)[cH]1[cH]2[c]3([cH]4[cH]56)C(C)C |
| Title of publication | Crystal structure of dichloro(N,N-dimethylpyridin-4-amine)-(μ^6^-p-cymene) ruthenium(II), RuCl2(C~7~H~10~N~2~)(C~10~H~14~) |
| Authors of publication | Kuan-Guan Liu; Xian-Chuan Li; Xiao-Qing Cai; Mao-Lin Hu |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2011 |
| Journal volume | 226 |
| Journal issue | 4 |
| Pages of publication | 533 |
| a | 15.01 ± 0.005 Å |
| b | 7.825 ± 0.003 Å |
| c | 20.903 ± 0.005 Å |
| α | 90° |
| β | 133.198 ± 0.014° |
| γ | 90° |
| Cell volume | 1789.8 ± 1.1 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0664 |
| Residual factor for significantly intense reflections | 0.0591 |
| Weighted residual factors for significantly intense reflections | 0.1098 |
| Weighted residual factors for all reflections included in the refinement | 0.1125 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.343 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176728 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 8. |
8103224.cif |
| 108108 | 2014-03-27 | cif/8/ (antanas@lokys.ibt.lt) Removing some extra characters introduced while converting CIF's from one encoding into the other. |
8103224.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
8103224.cif |
| 32566 | 2012-02-09 | ../uploads/cif-deposit/cod/cif Adding structures of 8103224 via cif-deposit CGI script. |
8103224.cif |
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