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Information card for entry 7703458
Preview
Coordinates | 7703458.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C20 H27 Br2 Cl F6 Ir N4 P |
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Calculated formula | C20 H27 Br2 Cl F6 Ir N4 P |
Title of publication | Novel iridium complexes with N-heterocyclic dicarbene ligands in light-driven water oxidation catalysis: photon management, ligand effect and catalyst evolution. |
Authors of publication | Volpe, Andrea; Natali, Mirco; Graiff, Claudia; Sartorel, Andrea; Tubaro, Cristina; Bonchio, Marcella |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2020 |
Journal volume | 49 |
Journal issue | 8 |
Pages of publication | 2696 - 2705 |
a | 13.798 ± 0.003 Å |
b | 12.135 ± 0.002 Å |
c | 15.46 ± 0.003 Å |
α | 90° |
β | 91.923 ± 0.003° |
γ | 90° |
Cell volume | 2587.1 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 8 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0672 |
Residual factor for significantly intense reflections | 0.038 |
Weighted residual factors for significantly intense reflections | 0.078 |
Weighted residual factors for all reflections included in the refinement | 0.0905 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7703458.html
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Users of the data should acknowledge the original authors of the
structural data.