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Information card for entry 4070517
Preview
| Coordinates | 4070517.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C55 H42 O6 P2 Ru3 S0 Se4 |
|---|---|
| Calculated formula | C55 H42 O6 P2 Ru3 Se4 |
| SMILES | [P]1(c2ccccc2)(C[P](c2ccccc2)(c2ccccc2)[Ru]23(C#[O])(C#[O])[Se]4[Ru](c5ccccc5)(C#[O])(C#[O])([Se]2c2ccccc2)[Se](c2ccccc2)[Ru]14(C#[O])(C#[O])[Se]3c1ccccc1)c1ccccc1 |
| Title of publication | Facile E−E and E−C Bond Activation of PhEEPh (E = Te, Se, S) by Ruthenium Carbonyl Clusters: Formation of Di- and Triruthenium Complexes Bearing Bridging dppm and Phenylchalcogenide and Capping Chalcogenido Ligands |
| Authors of publication | Begum, Noorjahan; Hyder, Md. Iqbal; Hassan, Mohammad R.; Kabir, Shariff E.; Bennett, Dennis W.; Haworth, Daniel T.; Siddiquee, Tasneem A.; Rokhsana, Dalia; Sharmin, Ayesha; Rosenberg, Edward |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 7 |
| Pages of publication | 1550 |
| a | 13.103 ± 0.002 Å |
| b | 13.604 ± 0.002 Å |
| c | 17.044 ± 0.003 Å |
| α | 95.79 ± 0.01° |
| β | 93.41 ± 0.01° |
| γ | 115.75 ± 0.01° |
| Cell volume | 2704.3 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0809 |
| Residual factor for significantly intense reflections | 0.0466 |
| Weighted residual factors for significantly intense reflections | 0.1037 |
| Weighted residual factors for all reflections included in the refinement | 0.1195 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| 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. |
4070517.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4070517.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4070517.cif |
| 41832 | 2012-03-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4070517 via cif-deposit CGI script. |
4070517.cif |
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