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Information card for entry 4107804
Preview
Coordinates | 4107804.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C56 H36 Cl4 F10 Hg N4 O4 Pd2 |
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Calculated formula | C56 H36 Cl4 F10 Hg N4 O4 Pd2 |
SMILES | c12ccccc2C=[N]2c3ccccc3[N]3=Cc4ccccc4O[Pd]23O1.[Hg](c1c(c(c(c(c1F)F)F)F)F)c1c(c(c(c(c1F)F)F)F)F.[Pd]123[N](c4c([N]1=Cc1c(cccc1)O2)cccc4)=Cc1ccccc1O3.ClCCCl.C(CCl)Cl |
Title of publication | Hg(II)...Pd(II) Metallophilic Interactions |
Authors of publication | Mieock Kim; Thomas J. Taylor; François P. Gabbaï |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2008 |
Journal volume | 130 |
Pages of publication | 6332 - 6333 |
a | 13.7936 ± 0.0008 Å |
b | 9.9402 ± 0.0006 Å |
c | 18.7739 ± 0.0011 Å |
α | 90° |
β | 92.146 ± 0.002° |
γ | 90° |
Cell volume | 2572.3 ± 0.3 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 8 |
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 | 0.0547 |
Residual factor for significantly intense reflections | 0.0347 |
Weighted residual factors for significantly intense reflections | 0.0662 |
Weighted residual factors for all reflections included in the refinement | 0.0724 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
Diffraction radiation wavelength | 0.71073 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/4107804.html
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