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Information card for entry 4337916
Preview
| Coordinates | 4337916.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C27 H31 N3 |
|---|---|
| Calculated formula | C27 H31 N3 |
| SMILES | N(=C(C)\c1nc(ccc1)/C(=N/c1c(cc(cc1C)C)C)C)/c1c(cc(cc1C)C)C |
| Title of publication | Multielectron C-O Bond Activation Mediated by a Family of Reduced Uranium Complexes. |
| Authors of publication | Kiernicki, John J.; Newell, Brian S.; Matson, Ellen M.; Anderson, Nickolas H.; Fanwick, Phillip E.; Shores, Matthew P.; Bart, Suzanne C. |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 7 |
| Pages of publication | 3730 |
| a | 8.2054 ± 0.0002 Å |
| b | 11.419 ± 0.0002 Å |
| c | 13.0767 ± 0.0009 Å |
| α | 79.305 ± 0.006° |
| β | 77.099 ± 0.005° |
| γ | 76.629 ± 0.005° |
| Cell volume | 1150.3 ± 0.09 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0685 |
| Residual factor for significantly intense reflections | 0.0459 |
| Weighted residual factors for significantly intense reflections | 0.1187 |
| Weighted residual factors for all reflections included in the refinement | 0.1639 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.177 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179482 (current) | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/79. |
4337916.cif |
| 110325 | 2014-04-18 | cod/cif/ (saulius@koala.ibt.lt) Appending periods (".") to author initials in the recently added bibliographies (using 'cif_reformat_pubmed_author_names'). |
4337916.cif |
| 109922 | 2014-04-17 | cif/ Updating files of 4337916, 4337917, 4337918, 4337919, 4337920, 4337921, 4337922, 4337923, 4337924 Original log message: Adding full bibliography for 4337916--4337924.cif. |
4337916.cif |
| 108487 | 2014-04-02 | cif/ Adding structures of 4337916, 4337917, 4337918, 4337919, 4337920, 4337921, 4337922, 4337923, 4337924 via cif-deposit CGI script. |
4337916.cif |
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Users of the data should acknowledge the original authors of the
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