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Information card for entry 4065901
Preview
| Coordinates | 4065901.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H62 Cl2 O3 P2 Ru |
|---|---|
| Calculated formula | C55 H62 Cl2 O3 P2 Ru |
| SMILES | [Ru]123([P](c4c(O1)cccc4)(C14CC5CC(CC(C1)C5)C4)c1ccccc1)([P](c1ccccc1O2)(C12CC4CC(CC(C1)C4)C2)c1ccccc1)[O](c1c(C=3)cccc1)C(C)C.ClCCl |
| Title of publication | Tuning the Steric Properties of a Metathesis Catalyst for Copolymerization of Norbornene and Cyclooctene toward Complete Alternation |
| Authors of publication | Torker, Sebastian; Müller, Andre; Sigrist, Raphael; Chen, Peter |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 12 |
| Pages of publication | 2735 |
| a | 15.5132 ± 0.0003 Å |
| b | 19.3796 ± 0.0004 Å |
| c | 15.9391 ± 0.0003 Å |
| α | 90° |
| β | 95.7919 ± 0.001° |
| γ | 90° |
| Cell volume | 4767.46 ± 0.16 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173 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 | 0.0964 |
| Residual factor for significantly intense reflections | 0.0691 |
| Weighted residual factors for significantly intense reflections | 0.1945 |
| Weighted residual factors for all reflections included in the refinement | 0.2121 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.347 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4065901.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4065901.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4065901.cif |
| 33722 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4065900, 4065901, 4065902, 4065903, 4065904, 4065905, 4065906 via cif-deposit CGI script. |
4065901.cif |
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Users of the data should acknowledge the original authors of the
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