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Information card for entry 4072035
Preview
| Coordinates | 4072035.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C37 H50 F6 N4 Rh S Sb |
|---|---|
| Calculated formula | C37 H50 F6 N4 Rh S Sb |
| SMILES | [Rh]1234([S]([C@@H](CN5N=CN(N6[C@@H](CC[C@H]6c6ccccc6)c6ccccc6)C=15)C(C)C)C1CCCCC1)[CH]1=[CH]2CC[CH]3=[CH]4CC1.[Sb](F)(F)(F)(F)(F)[F-] |
| Title of publication | Stereoselective Synthesis of Rhodium(I) 4-(Dialkylamino)triazol-5-ylidene Complexes |
| Authors of publication | Ros, Abel; Alcarazo, Manuel; Iglesias-Sigüenza, Javier; Díez, Elena; Álvarez, Eleuterio; Fernández, Rosario; Lassaletta, José M. |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 18 |
| Pages of publication | 4555 |
| a | 10.9659 ± 0.0013 Å |
| b | 14.9455 ± 0.0017 Å |
| c | 23.038 ± 0.002 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3775.7 ± 0.7 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0362 |
| Residual factor for significantly intense reflections | 0.0295 |
| Weighted residual factors for significantly intense reflections | 0.0511 |
| Weighted residual factors for all reflections included in the refinement | 0.0525 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178609 (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 4/07/20. |
4072035.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4072035.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4072035.cif |
| 44188 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4072035 via cif-deposit CGI script. |
4072035.cif |
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Users of the data should acknowledge the original authors of the
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