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Information card for entry 1569448
Preview
| Coordinates | 1569448.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C73.5 H70.1 B2 N4.75 O2 Ru S2 |
|---|---|
| Calculated formula | C73.502 H70.097 B2 N4.751 O2 Ru S2 |
| Title of publication | Photocrystallography of [Ru(bpy)2(dmso)2]2+ reveals an O-bonded metastable state |
| Authors of publication | Marr, Zoe Y.; Thapa Magar, Rajani; Fournier, Bertrand; Benedict, Jason B.; Rack, Jeffrey J. |
| Journal of publication | Chemical Science |
| Year of publication | 2023 |
| Journal volume | 14 |
| Journal issue | 26 |
| Pages of publication | 7279 - 7284 |
| a | 22.0415 ± 0.0009 Å |
| b | 14.2574 ± 0.0006 Å |
| c | 22.4105 ± 0.0009 Å |
| α | 90° |
| β | 119.253 ± 0.001° |
| γ | 90° |
| Cell volume | 6144.5 ± 0.4 Å3 |
| Cell temperature | 90 K |
| Ambient diffraction temperature | 90 K |
| Number of distinct elements | 7 |
| 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 | 0.0566 |
| Residual factor for significantly intense reflections | 0.0413 |
| Weighted residual factors for significantly intense reflections | 0.0975 |
| Weighted residual factors for all reflections included in the refinement | 0.1046 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 284996 (current) | 2023-07-06 | cif/ Adding structures of 1569446, 1569447, 1569448 via cif-deposit CGI script. |
1569448.cif |
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