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Information card for entry 7054769
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Coordinates | 7054769.cif |
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Original paper (by DOI) | HTML |
Chemical name | rac-bis(hexafluoroacetylacetonato)(tris(o-tolyl)phosphino)palladium(II) |
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Formula | C31 H23 F12 O4 P Pd |
Calculated formula | C31 H23 F12 O4 P Pd |
SMILES | C(C(=O)/C=C(C(F)(F)F)\O[Pd]1(OC(=CC(=[O]1)C(F)(F)F)C(F)(F)F)[P](c1c(cccc1)C)(c1c(cccc1)C)c1c(cccc1)C)(F)(F)F |
Title of publication | A missing link between chiral four- and five-coordinate complexes |
Authors of publication | Lennartson, Anders; Håkansson, Mikael |
Journal of publication | New J. Chem. |
Year of publication | 2015 |
Journal volume | 39 |
Journal issue | 5 |
Pages of publication | 3353 |
a | 11.351 ± 0.0014 Å |
b | 14.4276 ± 0.0017 Å |
c | 19.814 ± 0.002 Å |
α | 90° |
β | 95.639 ± 0.005° |
γ | 90° |
Cell volume | 3229.2 ± 0.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0237 |
Residual factor for significantly intense reflections | 0.0208 |
Weighted residual factors for significantly intense reflections | 0.053 |
Weighted residual factors for all reflections included in the refinement | 0.0539 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7054769.html
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