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Information card for entry 4064710
Preview
| Coordinates | 4064710.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H40 Cl2 O2 Os P2 S |
|---|---|
| Calculated formula | C26 H40 Cl2 O2 Os P2 S |
| SMILES | [Os]12([P](C(C)C)(C(C)C)c3cccc4c3[o]2c2c4cccc2[P]1(C(C)C)C(C)C)(Cl)(Cl)[S](=O)(C)C |
| Title of publication | Direct Access to POP-Type Osmium(II) and Osmium(IV) Complexes: Osmium a Promising Alternative to Ruthenium for the Synthesis of Imines from Alcohols and Amines |
| Authors of publication | Esteruelas, Miguel A.; Honczek, Nicole; Oliván, Montserrat; Oñate, Enrique; Valencia, Marta |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 9 |
| Pages of publication | 2468 |
| a | 10.525 ± 0.003 Å |
| b | 12.047 ± 0.003 Å |
| c | 22.521 ± 0.006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2855.5 ± 1.3 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 | 0.0413 |
| Residual factor for significantly intense reflections | 0.0334 |
| Weighted residual factors for significantly intense reflections | 0.057 |
| Weighted residual factors for all reflections included in the refinement | 0.0586 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.95 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178541 (current) | 2016-03-21 | cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/47. |
4064710.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4064710.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4064710.cif |
| 33014 | 2012-02-11 | ../uploads/cif-deposit/cod/cif Adding structures of 4064710, 4064711, 4064712 via cif-deposit CGI script. |
4064710.cif |
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