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Information card for entry 7031910
Preview
Coordinates | 7031910.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H46 Cl2 Co N2 O4 |
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Calculated formula | C40 H46 Cl2 Co N2 O4 |
SMILES | C(C)(C)(C)c1c2O[Co]345([O]=c6c(=[N]3c3cc(Cl)ccc3O4)cc(C(C)(C)C)cc6C(C)(C)C)[N](c2cc(C(C)(C)C)c1)=c1cc(Cl)ccc1=[O]5 |
Title of publication | Switching and redox isomerism in first-row transition metal complexes containing redox active Schiff base ligands. |
Authors of publication | Sasmal, Ashok; Garribba, Eugenio; Gómez-García, Carlos J; Desplanches, Cédric; Mitra, Samiran |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2014 |
Journal volume | 43 |
Journal issue | 42 |
Pages of publication | 15958 - 15967 |
a | 11.7645 ± 0.0003 Å |
b | 20.6993 ± 0.0006 Å |
c | 15.8548 ± 0.0004 Å |
α | 90° |
β | 97.786 ± 0.002° |
γ | 90° |
Cell volume | 3825.32 ± 0.18 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1112 |
Residual factor for significantly intense reflections | 0.0509 |
Weighted residual factors for significantly intense reflections | 0.1335 |
Weighted residual factors for all reflections included in the refinement | 0.1676 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.89 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7031910.html
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