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Information card for entry 7027015
Preview
Coordinates | 7027015.cif |
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Original paper (by DOI) | HTML |
Formula | C20 H21 Mn N2 O9 |
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Calculated formula | C20 H25 Mn N2 O9 |
SMILES | [Mn]123(Oc4c(OC)cccc4C=[N]2CC[N]3=Cc2cccc(OC)c2O1)(OC(=O)C)[OH2].O.O |
Title of publication | Further attempts to rationalise the co-ordination chemistry of manganese with Schiff base ligands and supplementary carboxylate donors |
Authors of publication | Watkinson, Michael; Fondo, Matilde; Bermejo, Manuel R.; Sousa, Antonio; McAuliffe, Charles A.; Pritchard, Robin G.; Jaiboon, Nongnuj; Aurangzeb, Nadeem; Naeem, Mohammed |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 1 |
Pages of publication | 31 |
a | 12.053 ± 0.002 Å |
b | 19.874 ± 0.004 Å |
c | 9.312 ± 0.002 Å |
α | 90° |
β | 99.97 ± 0.02° |
γ | 90° |
Cell volume | 2196.9 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0433 |
Residual factor for significantly intense reflections | 0.0433 |
Weighted residual factors for all reflections | 0.1186 |
Weighted residual factors for significantly intense reflections | 0.1186 |
Goodness-of-fit parameter for all reflections | 1.093 |
Goodness-of-fit parameter for significantly intense reflections | 1.093 |
Diffraction radiation wavelength | 0.71069 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/7027015.html
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