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Information card for entry 2219759
Preview
Coordinates | 2219759.cif |
---|---|
Structure factors | 2219759.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(<i>N</i>,<i>N</i>-dimethylformamide-κO)bis(1-methylimidazole-2- carbaldehyde oximato-κ^2^<i>N</i>,<i>O</i>)manganese(III) perchlorate |
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Formula | C16 H26 Cl Mn N8 O8 |
Calculated formula | C16 H26 Cl Mn N8 O8 |
SMILES | [Mn]12([n]3ccn(c3C=NO1)C)([n]1ccn(c1C=NO2)C)([O]=CN(C)C)[O]=CN(C)C.Cl(=O)(=O)(=O)[O-] |
Title of publication | Bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)bis(1-methylimidazole-2-carbaldehyde oximato-κ^2^<i>N</i>,<i>O</i>)manganese(III) perchlorate |
Authors of publication | Wang, Feng; Zhang, Jianming; Wang, Qirong; Huang, Shiying |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2008 |
Journal volume | 64 |
Journal issue | 11 |
Pages of publication | m1462 |
a | 7.6158 ± 0.0011 Å |
b | 12.324 ± 0.002 Å |
c | 12.86 ± 0.0016 Å |
α | 82.841 ± 0.01° |
β | 85.273 ± 0.011° |
γ | 80.471 ± 0.016° |
Cell volume | 1178.7 ± 0.3 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0741 |
Residual factor for significantly intense reflections | 0.0561 |
Weighted residual factors for significantly intense reflections | 0.1415 |
Weighted residual factors for all reflections included in the refinement | 0.1578 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.075 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2219759.html
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