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Information card for entry 7718376
Preview
| Coordinates | 7718376.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C96 H141 Ir8 N16 O2 |
|---|---|
| Calculated formula | C96 H141 Ir8 N16 O2 |
| Title of publication | Synthesis and characterization of 15N-labeled tetranuclear Ir complexes via Li2C15N2 |
| Authors of publication | Yan, Xuechao; Ji, Shu-Xiao; Zhang, Shengyuan; Wang, Qianru; Guo, Jianping; Chen, Ping; Xi, Zhenfeng; Wei, Junnian |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 34.1212 ± 0.0007 Å |
| b | 17.7347 ± 0.0003 Å |
| c | 16.664 ± 0.0003 Å |
| α | 90° |
| β | 101.54 ± 0.002° |
| γ | 90° |
| Cell volume | 9880 ± 0.3 Å3 |
| Cell temperature | 179.99 ± 0.1 K |
| Ambient diffraction temperature | 179.99 ± 0.1 K |
| Number of distinct elements | 5 |
| 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 | 0.0553 |
| Residual factor for significantly intense reflections | 0.0351 |
| Weighted residual factors for significantly intense reflections | 0.0668 |
| Weighted residual factors for all reflections included in the refinement | 0.0734 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.03 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298531 (current) | 2025-03-20 | cif/ Adding structures of 7718376, 7718377, 7718378 via cif-deposit CGI script. |
7718376.cif |
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Users of the data should acknowledge the original authors of the
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