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Information card for entry 4103548
Preview
| Coordinates | 4103548.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C37 H35 Co N4 |
|---|---|
| Calculated formula | C37 H35 Co N4 |
| SMILES | [Co]123N(C(c4[n]2c(C(=[N]1c1c(cc(cc1C)C)C)c1ccccc1)ccc4)c1ccccc1)c1c(cc(cc1C=[NH]3)C)C |
| Title of publication | Photolysis and Thermolysis of Bis(imino)pyridine Cobalt Azides: C-H Activation from Putative Cobalt Nitrido Complexes |
| Authors of publication | Crisita Carmen Hojilla Atienza; Amanda C. Bowman; Emil Lobkovsky; Paul J. Chirik |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2010 |
| Journal volume | 132 |
| Pages of publication | 16343 - 16345 |
| a | 9.898 ± 0.0006 Å |
| b | 13.3037 ± 0.0008 Å |
| c | 13.829 ± 0.0008 Å |
| α | 101.844 ± 0.003° |
| β | 101.392 ± 0.003° |
| γ | 103.947 ± 0.003° |
| Cell volume | 1670.19 ± 0.18 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0714 |
| Residual factor for significantly intense reflections | 0.0474 |
| Weighted residual factors for significantly intense reflections | 0.1287 |
| Weighted residual factors for all reflections included in the refinement | 0.1373 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301832 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/10/ Each referenced PubChem compound corresponds to the full crystal structure. |
4103548.cif |
| 178781 | 2016-03-21 | cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/35. |
4103548.cif |
| 120076 | 2014-07-11 | Adding DOIs to range 4/10 structures. | 4103548.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4103548.cif |
| 26536 | 2011-09-22 | ../uploads/cif-deposit/cod/cif Adding structures of 4103548 via cif-deposit CGI script. |
4103548.cif |
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Users of the data should acknowledge the original authors of the
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