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Information card for entry 2204904
Preview
Coordinates | 2204904.cif |
---|---|
Structure factors | 2204904.hkl |
Original IUCr paper | HTML |
Chemical name | catena-Poly[[bis(O,O'-dimethyl dithiophosphato-κ^2^S,S')cadmium(II)]-μ-4,4'-bipyridine-N:N'] |
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Formula | C14 H20 Cd N2 O4 P2 S4 |
Calculated formula | C14 H20 Cd N2 O4 P2 S4 |
SMILES | [Cd]12([S]=P(S1)(OC)OC)([S]=P(S2)(OC)OC)[n]1ccc(cc1)c1cc[n](cc1)[Cd]12([S]=P(S2)(OC)OC)([S]=P(S1)(OC)OC)[n]1ccc(cc1)c1ccncc1 |
Title of publication | <i>catena</i>-Poly[[bis(<i>O</i>,<i>O</i>'-dimethyl dithiophosphato-κ^2^<i>S</i>,<i>S</i>')cadmium(II)]-μ-4,4'-bipyridine-<i>N</i>:<i>N</i>'] |
Authors of publication | Tao Li; Zhi-Hua LI; Shao-Wu Du |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 1 |
Pages of publication | m95 - m97 |
a | 10.281 ± 0.003 Å |
b | 10.672 ± 0.004 Å |
c | 12.945 ± 0.005 Å |
α | 79.209 ± 0.015° |
β | 67.071 ± 0.012° |
γ | 63.502 ± 0.013° |
Cell volume | 1170.5 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0487 |
Residual factor for significantly intense reflections | 0.0418 |
Weighted residual factors for significantly intense reflections | 0.1024 |
Weighted residual factors for all reflections included in the refinement | 0.1086 |
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/2204904.html
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Users of the data should acknowledge the original authors of the
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