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Information card for entry 4349764
Preview
| Coordinates | 4349764.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H19 Br Mn N5 O4 |
|---|---|
| Calculated formula | C25 H19 Br Mn N5 O4 |
| SMILES | [Mn]1(C#[O])(Br)([n]2c3ccccc3[nH]c2c2[n]1c(c1nc3c([nH]1)cccc3)ccc2)(C#[O])C#[O].O=C(C)C |
| Title of publication | The CO release properties of κ2N1,N2Mn(i) tricarbonyl photoCORMs with tridentate benzimidazole coligands |
| Authors of publication | Mansour, Ahmed M.; Friedrich, Alexandra |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2017 |
| Journal volume | 4 |
| Journal issue | 9 |
| Pages of publication | 1517 |
| a | 28.855 ± 0.011 Å |
| b | 6.95 ± 0.003 Å |
| c | 25.152 ± 0.009 Å |
| α | 90° |
| β | 106.66 ± 0.03° |
| γ | 90° |
| Cell volume | 4832 ± 3 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0411 |
| Residual factor for significantly intense reflections | 0.0332 |
| Weighted residual factors for significantly intense reflections | 0.0825 |
| Weighted residual factors for all reflections included in the refinement | 0.0866 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 235807 (current) | 2019-11-24 | cif/ Adding structures of 4349763, 4349764 via cif-deposit CGI script. |
4349764.cif |
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