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Information card for entry 7006227
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| Coordinates | 7006227.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Bis(tetrahydrofurane)-mu-hydrido-thiobis(6-tert-butyl-4- methylphenolato)-lutetium(iii) dimer |
|---|---|
| Chemical name | Bis(tetrahydrofurane)-μ-hydrido-thiobis(6-tert-butyl-4-methylphenolato)- lutetium(III) dimer |
| Formula | C39 H65 Lu O5 S |
| Calculated formula | C39 H65 Lu O5 S |
| Title of publication | Lutetium alkyl and hydride complexes in a non-cyclopentadienyl coordination environment. |
| Authors of publication | Konkol, Marcin; Spaniol, Thomas P.; Kondracka, Małgorzata; Okuda, Jun |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2007 |
| Journal issue | 36 |
| Pages of publication | 4095 - 4102 |
| a | 29.835 ± 0.009 Å |
| b | 17.805 ± 0.006 Å |
| c | 18.098 ± 0.006 Å |
| α | 90° |
| β | 121.466 ± 0.005° |
| γ | 90° |
| Cell volume | 8200 ± 5 Å3 |
| Cell temperature | 140 ± 2 K |
| Ambient diffraction temperature | 140 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0332 |
| Residual factor for significantly intense reflections | 0.0256 |
| Weighted residual factors for significantly intense reflections | 0.0633 |
| Weighted residual factors for all reflections included in the refinement | 0.0682 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.987 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179766 (current) | 2016-03-25 | cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/62. |
7006227.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7006227.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7006227.cif |
| 1186 | 2010-06-03 | Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing. | 7006227.cif |
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