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Information card for entry 2021580
Preview
| Coordinates | 2021580.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | μ-Acetato-1κ<i>O</i>:2κ<i>O</i>'-μ-propanoato-1κ<i>O</i>:2κ<i>O</i>'-bis[tris(4-methylphenyl)phosphane]-1κ<i>P</i>,2κ<i>P</i>'-bis(dicarbonylosmium)(<i>Os</i>—<i>Os</i>) dichloromethane monosolvate |
|---|---|
| Formula | C52 H52 Cl2 O8 Os2 P2 |
| Calculated formula | C52 H52 Cl2 O8 Os2 P2 |
| Title of publication | Asymmetric diosmium sawhorse complexes |
| Authors of publication | Wilson, Kylie M.; Swartout, John W.; Touchton, Henry A.; Lambert, Erica N.; Johnstone, James E.; Archambeau, Ashley K.; Marolf, David M.; Mikeska, Emily R.; Lynch, Vincent M.; Nesterov, Vladimir N.; Reinheimer, Eric W.; Powell, Gregory L.; Powell, Cynthia B. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 5 |
| Pages of publication | 529 - 537 |
| a | 18.5007 ± 0.0004 Å |
| b | 18.5396 ± 0.0004 Å |
| c | 14.809 ± 0.0003 Å |
| α | 90° |
| β | 91.9976 ± 0.0017° |
| γ | 90° |
| Cell volume | 5076.33 ± 0.19 Å3 |
| Cell temperature | 100.01 ± 0.1 K |
| Ambient diffraction temperature | 100.01 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0267 |
| Residual factor for significantly intense reflections | 0.0232 |
| Weighted residual factors for significantly intense reflections | 0.0531 |
| Weighted residual factors for all reflections included in the refinement | 0.0548 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.998 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 215660 (current) | 2019-06-03 | cif/ Updating files of 2021580, 2021581, 2021582, 2021583, 2021584, 2021585, 2021586, 2021587 Original log message: Adding full bibliography for 2021580--2021587.cif. |
2021580.cif |
| 214580 | 2019-04-10 | cif/ hkl/ Adding structures of 2021580, 2021581, 2021582, 2021583, 2021584, 2021585, 2021586, 2021587 via cif-deposit CGI script. |
2021580.cif |
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Users of the data should acknowledge the original authors of the
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