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Information card for entry 4070572
Preview
| Coordinates | 4070572.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C61 H54 Cl2 F3 N2 O9 Os P4 Rh S |
|---|---|
| Calculated formula | C61 H54 Cl2 F3 N2 O9 Os P4 Rh S |
| SMILES | [Os]123([P](C[P]([Rh]([P](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([N]2=NC(=C3O)C(=O)OCC)C#[O])(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O].S(=O)(=O)([O-])C(F)(F)F.ClCCCl |
| Title of publication | Coordination and Activation of Diazoalkanes in the Presence of Rh/Ru and Rh/Os Metal Combinations |
| Authors of publication | Samant, Rahul G.; Graham, Todd W.; Rowsell, Bryan D.; McDonald, Robert; Cowie, Martin |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 13 |
| Pages of publication | 3070 |
| a | 11.3899 ± 0.0007 Å |
| b | 15.0631 ± 0.0009 Å |
| c | 18.4369 ± 0.0011 Å |
| α | 87.7008 ± 0.0012° |
| β | 76.4194 ± 0.0011° |
| γ | 88.4252 ± 0.0011° |
| Cell volume | 3071.7 ± 0.3 Å3 |
| Cell temperature | 193 ± 2 K |
| Ambient diffraction temperature | 193 ± 2 K |
| Number of distinct elements | 10 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0304 |
| Residual factor for significantly intense reflections | 0.0281 |
| Weighted residual factors for significantly intense reflections | 0.0743 |
| Weighted residual factors for all reflections included in the refinement | 0.0765 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178594 (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 4/07/05. |
4070572.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070572.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070572.cif |
| 42568 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070572 via cif-deposit CGI script. |
4070572.cif |
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Users of the data should acknowledge the original authors of the
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