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Information card for entry 7014060
Preview
Coordinates | 7014060.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | [Co(N4samp)Cl](ZnCl4) |
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Formula | C10 H26 Cl5 Co N4 S Zn |
Calculated formula | C10 H26 Cl5 Co N4 S Zn |
SMILES | [Zn](Cl)(Cl)([Cl-])[Cl-].[Co]1234(Cl)[S](CC(C[NH2]3)(C)C[NH2]2)CC(C[NH2]4)(C[NH2]1)C |
Title of publication | Synthesis, characterization and DFT studies of the cobalt(III) complex of a tetrapodal pentadentate N4S donor ligand. |
Authors of publication | Sharrad, Clint A.; Cavigliasso, Germán E; Stranger, Robert; Gahan, Lawrence R. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2004 |
Journal issue | 8 |
Pages of publication | 1166 - 1172 |
a | 7.861 ± 0.002 Å |
b | 15.432 ± 0.002 Å |
c | 16.856 ± 0.002 Å |
α | 90° |
β | 98.64 ± 0.02° |
γ | 90° |
Cell volume | 2021.6 ± 0.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0869 |
Residual factor for significantly intense reflections | 0.051 |
Weighted residual factors for all reflections | 0.1518 |
Weighted residual factors for significantly intense reflections | 0.1338 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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