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Information card for entry 1548901
Preview
Coordinates | 1548901.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H29 Co F6 N5 O6 S2 |
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Calculated formula | C18 H29 Co F6 N5 O6 S2 |
SMILES | [Co]123([n]4ccc(N(C)C)cc4C[N]41CC[N]2(C)CC[N]3(C)CC4)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F |
Title of publication | Understanding light-driven H<sub>2</sub> evolution through the electronic tuning of aminopyridine cobalt complexes. |
Authors of publication | Call, Arnau; Franco, Federico; Kandoth, Noufal; Fernández, Sergio; González-Béjar, María; Pérez-Prieto, Julia; Luis, Josep M.; Lloret-Fillol, Julio |
Journal of publication | Chemical science |
Year of publication | 2018 |
Journal volume | 9 |
Journal issue | 9 |
Pages of publication | 2609 - 2619 |
a | 8.802 ± 0.002 Å |
b | 24.936 ± 0.006 Å |
c | 12.694 ± 0.003 Å |
α | 90° |
β | 94.038 ± 0.005° |
γ | 90° |
Cell volume | 2779.2 ± 1.1 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 7 |
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 | 0.1031 |
Residual factor for significantly intense reflections | 0.0767 |
Weighted residual factors for significantly intense reflections | 0.2182 |
Weighted residual factors for all reflections included in the refinement | 0.2483 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
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/1548901.html
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Users of the data should acknowledge the original authors of the
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