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Information card for entry 4071720
Preview
| Coordinates | 4071720.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C46 H54 B N2 O V |
|---|---|
| Calculated formula | C46 H54 B N2 O V |
| SMILES | [V]1234([O]5CCCC5)(=Nc5ccc(cc5)C)(N(C(C)C)C(C)C)[cH]5[cH]1[cH]2[cH]3[cH]45.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1 |
| Title of publication | Relative Reactivity of the Metal−Amido versus Metal−Imido Bond in Linked Cp-Amido and Half-Sandwich Complexes of Vanadium |
| Authors of publication | Bouwkamp, Marco W.; Batinas, Aurora A.; Witte, Peter T.; Hubregtse, Ton; Dam, Jeroen; Meetsma, Auke; Teuben, Jan H.; Hessen, Bart |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 16 |
| Pages of publication | 4071 |
| a | 9.2873 ± 0.0009 Å |
| b | 12.827 ± 0.001 Å |
| c | 16.83 ± 0.002 Å |
| α | 93.63 ± 0.002° |
| β | 94.974 ± 0.002° |
| γ | 104.1 ± 0.001° |
| Cell volume | 1929.8 ± 0.3 Å3 |
| Cell temperature | 100 ± 1 K |
| Ambient diffraction temperature | 100 ± 1 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 | 0.1211 |
| Residual factor for significantly intense reflections | 0.0823 |
| Weighted residual factors for significantly intense reflections | 0.2059 |
| Weighted residual factors for all reflections included in the refinement | 0.2313 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178606 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/17. |
4071720.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4071720.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071720.cif |
| 43996 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4071720 via cif-deposit CGI script. |
4071720.cif |
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Users of the data should acknowledge the original authors of the
structural data.