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Information card for entry 8106788
Preview
| Coordinates | 8106788.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C33 H27 Ir N2 O6 |
|---|---|
| Calculated formula | C33 H27 Ir N2 O6 |
| Title of publication | Crystal structure of (acetylacetonato-κ2 O:O′)bis-((1-(2-hydroxyphenyl)-3-(pyridin-2-yl)prop-2-en-1-one)-κ2 C,N)iridium(III), C33H27IrN2O6 |
| Authors of publication | Ren, Yun-Lai; Wang, Wen-Hui; Wang, Bin-Yu; Wang, Zhi-Qiang |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2016 |
| Journal volume | 231 |
| Journal issue | 1 |
| Pages of publication | 71 - 73 |
| a | 7.484 ± 0.0011 Å |
| b | 11.7312 ± 0.0017 Å |
| c | 17.438 ± 0.002 Å |
| α | 76.259 ± 0.002° |
| β | 89.549 ± 0.002° |
| γ | 74.023 ± 0.002° |
| Cell volume | 1427 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0319 |
| Residual factor for significantly intense reflections | 0.028 |
| Weighted residual factors for significantly intense reflections | 0.0677 |
| Weighted residual factors for all reflections included in the refinement | 0.0697 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281191 (current) | 2023-03-01 | cif/ Adding structures of 8106788 via cif-deposit CGI script. |
8106788.cif |
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Users of the data should acknowledge the original authors of the
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