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Information card for entry 7032843
Preview
| Coordinates | 7032843.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | complex_5_benzyl |
|---|---|
| Chemical name | benzyl(eta-5-pentamethylcyclopentadienyl) (eta-8-(bis{triisopropylsilyl}cyclooctatetraene))thorium(IV) |
| Formula | C43 H70 Si2 Th |
| Calculated formula | C43 H70 Si2 Th |
| Title of publication | Mixed sandwich thorium complexes incorporating bis(tri-isopropylsilyl)cyclooctatetraenyl and pentamethylcyclopentadienyl ligands: synthesis, structure and reactivity. |
| Authors of publication | Button, Zoë E; Higgins, Jessica A.; Suvova, Markéta; Cloke, F Geoffrey N; Roe, S. Mark |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2015 |
| Journal volume | 44 |
| Journal issue | 6 |
| Pages of publication | 2588 - 2596 |
| a | 13.017 ± 0.0002 Å |
| b | 17.3983 ± 0.0003 Å |
| c | 20.0305 ± 0.0003 Å |
| α | 82.3334 ± 0.0009° |
| β | 75.2024 ± 0.0009° |
| γ | 69.8092 ± 0.0007° |
| Cell volume | 4111.28 ± 0.12 Å3 |
| Cell temperature | 173 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.058 |
| Residual factor for significantly intense reflections | 0.0339 |
| Weighted residual factors for significantly intense reflections | 0.0677 |
| Weighted residual factors for all reflections included in the refinement | 0.0869 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.119 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180034 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/28. |
7032843.cif |
| 133341 | 2015-03-06 | cif/ Updating files of 7032839, 7032840, 7032841, 7032842, 7032843, 7032844 Original log message: Adding full bibliography for 7032839--7032844.cif. |
7032843.cif |
| 125574 | 2014-10-21 | cif/ Adding structures of 7032839, 7032840, 7032841, 7032842, 7032843, 7032844 via cif-deposit CGI script. |
7032843.cif |
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Users of the data should acknowledge the original authors of the
structural data.