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Information card for entry 7004983
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| Coordinates | 7004983.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [ZrCl{Me3SiNC(C6H4Me)NPh}3].3(toluene) |
|---|---|
| Formula | C72 H87 Cl N6 Si3 Zr |
| Calculated formula | C72 H79 Cl N6 Si3 Zr |
| Title of publication | Synthesis and structures of selected benzamidinates of Li, Na, Al, Zr and Sn(II) using the C1-symmetric ligands [N(SiMe3)C(C6H4Me-4 or Ph)NPh]-. |
| Authors of publication | Hitchcock, Peter B.; Lappert, Michael F.; Merle, Philippe G. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2007 |
| Journal issue | 5 |
| Pages of publication | 585 - 594 |
| a | 14.1992 ± 0.0005 Å |
| b | 16.9004 ± 0.0007 Å |
| c | 17.7967 ± 0.0007 Å |
| α | 114.887 ± 0.002° |
| β | 98.208 ± 0.002° |
| γ | 105.088 ± 0.002° |
| Cell volume | 3582 ± 0.3 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1034 |
| Residual factor for significantly intense reflections | 0.0818 |
| Weighted residual factors for significantly intense reflections | 0.2103 |
| Weighted residual factors for all reflections included in the refinement | 0.2258 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.099 |
| 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 |
|---|---|---|---|
| 179753 (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 7/00/49. |
7004983.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7004983.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7004983.cif |
| 1186 | 2010-06-03 | Adding CIFs from Chem-Comm-2010_20-22/ and Dalton-Trans-2007/ processing. | 7004983.cif |
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Users of the data should acknowledge the original authors of the
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