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Information card for entry 7707209
Preview
Coordinates | 7707209.cif |
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Original paper (by DOI) | HTML |
Formula | C108 H64 Cl6 Ir2 N8 |
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Calculated formula | C108 H64 Cl6 Ir2 N8 |
Title of publication | Sterically hindered phenanthroimidazole ligands drive the structural flexibility and facile ligand exchange in cyclometalated iridium(III) complexes. |
Authors of publication | Tatarin, Sergei V.; Kalle, Paulina; Taydakov, Ilya V.; Varaksina, Evgenia A.; Korshunov, Vladislav M.; Bezzubov, Stanislav I. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2021 |
Journal volume | 50 |
Journal issue | 20 |
Pages of publication | 6889 - 6900 |
a | 17.8595 ± 0.0011 Å |
b | 18.4756 ± 0.001 Å |
c | 19.4513 ± 0.0011 Å |
α | 69.415 ± 0.002° |
β | 64.151 ± 0.002° |
γ | 79.109 ± 0.002° |
Cell volume | 5402.4 ± 0.5 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.0612 |
Residual factor for significantly intense reflections | 0.0485 |
Weighted residual factors for significantly intense reflections | 0.1327 |
Weighted residual factors for all reflections included in the refinement | 0.1405 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7707209.html
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Users of the data should acknowledge the original authors of the
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