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Information card for entry 2014410
Preview
Coordinates | 2014410.cif |
---|---|
Structure factors | 2014410.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(μ-diphenylphosphinato-κ^2^O:O')bis[aqua(diphenylphosphinato- κO)bis(pyridine-κN)cobalt(II)] |
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Formula | C68 H64 Co2 N4 O10 P4 |
Calculated formula | C68 H64 Co2 N4 O10 P4 |
SMILES | [OH2][Co]1([n]2ccccc2)(OP(=O)(c2ccccc2)c2ccccc2)([n]2ccccc2)[O]=P(c2ccccc2)(O[Co]([OH2])([n]2ccccc2)([n]2ccccc2)([O]=P(O1)(c1ccccc1)c1ccccc1)OP(=O)(c1ccccc1)c1ccccc1)c1ccccc1 |
Title of publication | Bis(μ-diphenylphosphinato-κ^2^<i>O</i>:<i>O</i>')bis[aqua(diphenylphosphinato-κ<i>O</i>)bis(pyridine-κ<i>N</i>)cobalt(II)] |
Authors of publication | Liange de Oliveira Diehl; Márcia R. Siqueira; Robert A. Burrow |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 2 |
Pages of publication | m67 - m69 |
a | 10.7871 ± 0.0004 Å |
b | 11.8221 ± 0.0004 Å |
c | 12.7061 ± 0.0005 Å |
α | 91.609 ± 0.002° |
β | 90.39 ± 0.002° |
γ | 92.774 ± 0.002° |
Cell volume | 1617.77 ± 0.1 Å3 |
Cell temperature | 294 ± 2 K |
Ambient diffraction temperature | 294 ± 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 | 0.0565 |
Residual factor for significantly intense reflections | 0.0337 |
Weighted residual factors for significantly intense reflections | 0.0843 |
Weighted residual factors for all reflections included in the refinement | 0.091 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
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/2014410.html
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Users of the data should acknowledge the original authors of the
structural data.