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Information card for entry 7012059
Preview
| Coordinates | 7012059.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | [Zn{N(SiMe3)2}{MesNPPh2CHPPh2NMes}] |
|---|---|
| Formula | C44 H62 B2 Mo N2 O2 |
| Calculated formula | C44 H62 B2 Mo N2 O2 |
| Title of publication | Transition-metal imido-boroxide complexes: a structural and spectroscopic investigation of the influence of boron |
| Authors of publication | Cole, Sarah C.; Coles, Martyn P.; Hitchcock, Peter B. |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 2002 |
| Journal issue | 22 |
| Pages of publication | 4168 |
| a | 19.0505 ± 0.0006 Å |
| b | 27.3517 ± 0.0007 Å |
| c | 8.4738 ± 0.0002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4415.4 ± 0.2 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 41 |
| Hermann-Mauguin space group symbol | A b a 2 |
| Hall space group symbol | A 2 -2ab |
| Residual factor for all reflections | 0.0609 |
| Residual factor for significantly intense reflections | 0.0387 |
| Weighted residual factors for significantly intense reflections | 0.0795 |
| Weighted residual factors for all reflections included in the refinement | 0.0909 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| 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 |
|---|---|---|---|
| 213973 (current) | 2019-03-05 | cod/ Removed potentially copyrighted or irrelevant data items from 1289 entries. |
7012059.cif |
| 179824 | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/20. |
7012059.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7012059.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7012059.cif |
| 3896 | 2010-12-08 | cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/. |
7012059.cif |
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Users of the data should acknowledge the original authors of the
structural data.