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Information card for entry 2019156
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| Coordinates | 2019156.cif |
|---|---|
| Structure factors | 2019156.hkl |
| Original IUCr paper | HTML |
| Chemical name | (Azido-κ<i>N</i>)[1,1,',1''-(phenylboranetriyl)tris(3-<i>tert</i>-butyl-1<i>H</i>-imidazol-2-ylidene)]cobalt(II) |
|---|---|
| Formula | C27 H38 B Co N9 |
| Calculated formula | C27 H38 B Co N9 |
| Title of publication | Cobalt azide complexes with a tris(carbene)borate ligand scaffold |
| Authors of publication | Scepaniak, Jeremiah J.; Margarit, Charles G.; Bontchev, Ranko P.; Smith, Jeremy M. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 9 |
| Pages of publication | 968 - 971 |
| a | 9.891 ± 0.0003 Å |
| b | 17.7415 ± 0.0005 Å |
| c | 16.166 ± 0.0005 Å |
| α | 90° |
| β | 92.016 ± 0.002° |
| γ | 90° |
| Cell volume | 2835.07 ± 0.15 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0891 |
| Residual factor for significantly intense reflections | 0.043 |
| Weighted residual factors for significantly intense reflections | 0.0896 |
| Weighted residual factors for all reflections included in the refinement | 0.1065 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180860 (current) | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/91. |
2019156.cif 2019156.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019156.cif 2019156.hkl |
| 89416 | 2013-10-25 | cif/ (saulius@koala.ibt.lt) Adding links pointing to FOBS data to the recently deposited structures from IUCr. |
2019156.cif 2019156.hkl |
| 89414 | 2013-10-24 | cod/ (saulius@koala.ibt.lt) Adding FOBS data for the recently deposited IUCr structures. |
2019156.cif 2019156.hkl |
| 88741 | 2013-10-02 | cif/ Adding structures of 2019156, 2019157 via cif-deposit CGI script. |
2019156.cif |
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