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Information card for entry 2208694
Preview
Coordinates | 2208694.cif |
---|---|
Structure factors | 2208694.hkl |
Original IUCr paper | HTML |
Chemical name | Bis(diphenylphosphinato-κO)bis(diphenylphosphinic acid-κO)bis(pyridine-κN)mercury(II) |
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Formula | C58 H52 Hg N2 O8 P4 |
Calculated formula | C58 H52 Hg N2 O8 P4 |
SMILES | [Hg](OP(=O)(c1ccccc1)c1ccccc1)(OP(=O)(c1ccccc1)c1ccccc1)([O]=P(O)(c1ccccc1)c1ccccc1)([O]=P(O)(c1ccccc1)c1ccccc1)([n]1ccccc1)[n]1ccccc1 |
Title of publication | Bis(diphenylphosphinato-κ<i>O</i>)bis(diphenylphosphinic acid-κ<i>O</i>)bis(pyridine-κ<i>N</i>)mercury(II) |
Authors of publication | Márcia R. Siqueira; Javier Ellena; Robert A. Burrow |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 4 |
Pages of publication | m816 - m818 |
a | 9.4511 ± 0.0003 Å |
b | 12.3528 ± 0.0005 Å |
c | 12.6391 ± 0.0004 Å |
α | 101.853 ± 0.002° |
β | 109.278 ± 0.002° |
γ | 95.797 ± 0.002° |
Cell volume | 1340.19 ± 0.08 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 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 | 0.0571 |
Residual factor for significantly intense reflections | 0.0466 |
Weighted residual factors for significantly intense reflections | 0.11 |
Weighted residual factors for all reflections included in the refinement | 0.1152 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/2208694.html
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Users of the data should acknowledge the original authors of the
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