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Information card for entry 7005083
Preview
| Coordinates | 7005083.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H21 Cl F18 Gd N4 O11 Re |
|---|---|
| Calculated formula | C42 H21 Cl F18 Gd N4 O11 Re |
| SMILES | [Re]1(Cl)([n]2c(cccc2)c2[n]1c1c(nc2c2ncccc2)cccc1)(C#[O])(C#[O])C#[O].[Gd]123([OH2])([OH2])([O]=C(C=C(O1)C(F)(F)F)C(F)(F)F)(OC(=CC(=[O]2)C(F)(F)F)C(F)(F)F)[O]=C(C=C(O3)C(F)(F)F)C(F)(F)F.c1ccccc1 |
| Title of publication | Sensitised near-infrared luminescence from lanthanide(III) centres using Re(I) and Pt(II) diimine complexes as energy donors in d-f dinuclear complexes based on 2,3-bis(2-pyridyl)pyrazine. |
| Authors of publication | Kennedy, Frazer; Shavaleev, Nail M.; Koullourou, Thelma; Bell, Zoë R; Jeffery, John C.; Faulkner, Stephen; Ward, Michael D. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2007 |
| Journal issue | 15 |
| Pages of publication | 1492 - 1499 |
| a | 9.525 ± 0.002 Å |
| b | 13.034 ± 0.003 Å |
| c | 23.796 ± 0.006 Å |
| α | 105.83 ± 0.03° |
| β | 90.746 ± 0.019° |
| γ | 108.622 ± 0.017° |
| Cell volume | 2677.1 ± 1.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0883 |
| Residual factor for significantly intense reflections | 0.0649 |
| Weighted residual factors for significantly intense reflections | 0.1795 |
| Weighted residual factors for all reflections included in the refinement | 0.1907 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.067 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179754 (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 7/00/50. |
7005083.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7005083.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7005083.cif |
| 1186 | 2010-06-03 | Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing. | 7005083.cif |
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