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Information card for entry 4084664
Preview
| Coordinates | 4084664.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C30 H28 O Ru |
|---|---|
| Calculated formula | C30 H28 O Ru |
| SMILES | [Ru]12345678([CH]9=[CH]1c1c([CH]2=[CH]3c2c9cccc2)cccc1)[c]12cccc[c]82[cH]7[cH]6[cH]5[cH]41.O1CCCC1 |
| Title of publication | Regio- and Enantioselective Linear Cross-Dimerizations between Conjugated Dienes and Acrylates Catalyzed by New Ru(0) Complexes |
| Authors of publication | Hiroi, Yuki; Komine, Nobuyuki; Komiya, Sanshiro; Hirano, Masafumi |
| Journal of publication | Organometallics |
| Year of publication | 2014 |
| Journal volume | 33 |
| Journal issue | 22 |
| Pages of publication | 6604 |
| a | 8.741 ± 0.004 Å |
| b | 11.49 ± 0.006 Å |
| c | 22.177 ± 0.011 Å |
| α | 90° |
| β | 91.374 ± 0.007° |
| γ | 90° |
| Cell volume | 2226.7 ± 1.9 Å3 |
| Cell temperature | 200 K |
| Ambient diffraction temperature | 200 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for significantly intense reflections | 0.0398 |
| Weighted residual factors for all reflections included in the refinement | 0.1066 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275193 (current) | 2022-05-07 | cif/4/08/46/ Replaced the '' sequences with backslash symbols ('\') in multiple data values in entries 4084662-4084666. |
4084664.cif |
| 178735 | 2016-03-21 | cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/46. |
4084664.cif |
| 131426 | 2015-02-07 | cif/ Updating files of 4084661, 4084662, 4084663, 4084664, 4084665, 4084666 Original log message: Adding full bibliography for 4084661--4084666.cif. |
4084664.cif |
| 126676 | 2014-11-08 | cif/ Adding structures of 4084661, 4084662, 4084663, 4084664, 4084665, 4084666 via cif-deposit CGI script. |
4084664.cif |
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Users of the data should acknowledge the original authors of the
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