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Information card for entry 4088626
Preview
| Coordinates | 4088626.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H7 Cl7 O Ti |
|---|---|
| Calculated formula | C15 H7 Cl7 O Ti |
| SMILES | [cH]12[cH]3[c]45cccc[c]65[Ti]134(Oc1c(Cl)c(c(c(c1Cl)Cl)Cl)Cl)(Cl)([cH]26)Cl |
| Title of publication | Efficient Norbornene (NBE) Incorporation in Ethylene/NBE Copolymerization by Half-Titanocene Catalysts Containing Chlorinated Aryloxo Ligands |
| Authors of publication | Zhao, Weizhen; Yan, Qing; Tsutsumi, Ken; Nomura, Kotohiro |
| Journal of publication | Organometallics |
| Year of publication | 2016 |
| Journal volume | 35 |
| Journal issue | 11 |
| Pages of publication | 1895 |
| a | 6.37 ± 0.003 Å |
| b | 13.996 ± 0.006 Å |
| c | 10.509 ± 0.005 Å |
| α | 90° |
| β | 101.353 ± 0.006° |
| γ | 90° |
| Cell volume | 918.6 ± 0.7 Å3 |
| Cell temperature | 273 K |
| Ambient diffraction temperature | 273 K |
| Number of distinct elements | 5 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for significantly intense reflections | 0.0414 |
| Weighted residual factors for all reflections included in the refinement | 0.2193 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.182 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 237720 (current) | 2019-11-24 | cif/ Adding structures of 4088622, 4088623, 4088624, 4088625, 4088626, 4088627 via cif-deposit CGI script. |
4088626.cif |
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Users of the data should acknowledge the original authors of the
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