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Information card for entry 7032841
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| Coordinates | 7032841.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | complex_3_carbonate |
|---|---|
| Chemical name | (mu-carbonato)bis{(eta-5-pentamethylcyclopentadienyl) (eta-8-(bis{triisopropylsilyl}cyclooctatetraene))thorium(IV)} |
| Formula | C43.5 H71 O1.5 Si2 Th |
| Calculated formula | C43.5 H71 O1.5 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 | 12.283 ± 0.003 Å |
| b | 13.356 ± 0.003 Å |
| c | 15.689 ± 0.003 Å |
| α | 65.93 ± 0.03° |
| β | 67.92 ± 0.03° |
| γ | 72.3 ± 0.03° |
| Cell volume | 2142.8 ± 1 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173.15 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0329 |
| Residual factor for significantly intense reflections | 0.0277 |
| Weighted residual factors for significantly intense reflections | 0.0605 |
| Weighted residual factors for all reflections included in the refinement | 0.0624 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176453 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7032841.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. |
7032841.cif |
| 125574 | 2014-10-21 | cif/ Adding structures of 7032839, 7032840, 7032841, 7032842, 7032843, 7032844 via cif-deposit CGI script. |
7032841.cif |
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Users of the data should acknowledge the original authors of the
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