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Information card for entry 4070485
Preview
| Coordinates | 4070485.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H32 Cl2 O S2 Si Ti |
|---|---|
| Calculated formula | C26 H32 Cl2 O S2 Si Ti |
| SMILES | [Ti]12345(Cl)(Cl)Oc6c([Si]([c]71[c]12[c]3([c]24[c]57SC(=C2)C)C=C(S1)C)(CC)CC)cc(cc6C(C)(C)C)C |
| Title of publication | Titanium Complexes of Silicon-Bridged Cyclopentadienyl−Phenoxy Ligands Modified with Fused-Thiophene: Synthesis, Characterization, and Their Catalytic Performance in Copolymerization of Ethylene and 1-Hexene |
| Authors of publication | Senda, Taichi; Hanaoka, Hidenori; Okado, Yoshiya; Oda, Yoshiaki; Tsurugi, Hayato; Mashima, Kazushi |
| Journal of publication | Organometallics |
| Year of publication | 2009 |
| Journal volume | 28 |
| Journal issue | 24 |
| Pages of publication | 6915 |
| a | 9.565 ± 0.002 Å |
| b | 11.509 ± 0.003 Å |
| c | 25.216 ± 0.006 Å |
| α | 90° |
| β | 97.289 ± 0.004° |
| γ | 90° |
| Cell volume | 2753.4 ± 1.1 Å3 |
| Cell temperature | 113 ± 2 K |
| Ambient diffraction temperature | 113 ± 2 K |
| Number of distinct elements | 7 |
| 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 | 0.0851 |
| Residual factor for significantly intense reflections | 0.0621 |
| Weighted residual factors for significantly intense reflections | 0.1596 |
| Weighted residual factors for all reflections included in the refinement | 0.1872 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.122 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178593 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/04. |
4070485.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4070485.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070485.cif |
| 40735 | 2012-03-08 | ../uploads/cif-deposit/cod/cif Adding structures of 4070484, 4070485, 4070486 via cif-deposit CGI script. |
4070485.cif |
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Users of the data should acknowledge the original authors of the
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