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Information card for entry 7112611
Preview
Coordinates | 7112611.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H54 Co F6 N4 Sb |
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Calculated formula | C36 H54 Co F6 N4 Sb |
SMILES | [Sb](F)(F)(F)(F)(F)[F-].[Co]123Nc4c(cc(cc4C=[N]1[C@@H]1CCCC[C@H]1[N]2=Cc1cc(cc(c1N3)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C |
Title of publication | A singlet ground state for a cobalt(II)-anilinosalen radical complex |
Authors of publication | Amelie Kochem; Gisele Gellon; Olivier Jarjayes; Christian Philouze; Nicolas Leconte; Maurice van Gastel; Eckhard Bill; Fabrice Thomas |
Journal of publication | Chem.Commun. |
Year of publication | 2014 |
Journal volume | 50 |
Pages of publication | 4924 |
a | 23.028 ± 0.003 Å |
b | 18.156 ± 0.003 Å |
c | 19.131 ± 0.005 Å |
α | 90° |
β | 100.136 ± 0.012° |
γ | 90° |
Cell volume | 7874 ± 3 Å3 |
Cell temperature | 200 K |
Ambient diffraction temperature | 200 K |
Number of distinct elements | 6 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0915 |
Residual factor for significantly intense reflections | 0.046 |
Weighted residual factors for significantly intense reflections | 0.0849 |
Weighted residual factors for all reflections included in the refinement | 0.0981 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
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/7112611.html
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