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Information card for entry 4067922
Preview
Coordinates | 4067922.cif |
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Original paper (by DOI) | HTML |
Formula | C17 H15 Cl N2 O Pt |
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Calculated formula | C17 H15 Cl N2 O Pt |
SMILES | [Pt]1([n]2c(c3[n]1cccc3)cccc2)(Cl)c1ccc(cc1)OC |
Title of publication | Activation of Anisole by Organoplatinum(II) Complexes: Evidence for Rate-Determining C‒H Activation |
Authors of publication | Bonnington, Kevin J.; Zhang, Fenbao; Moustafa, Mahmoud M. Abd Rabo; Cooper, Benjamin F. T.; Jennings, Michael C.; Puddephatt, Richard J. |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 1 |
Pages of publication | 306 |
a | 7.1077 ± 0.0003 Å |
b | 10.4427 ± 0.0006 Å |
c | 20.5971 ± 0.0009 Å |
α | 90° |
β | 92.043 ± 0.003° |
γ | 90° |
Cell volume | 1527.82 ± 0.13 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0685 |
Residual factor for significantly intense reflections | 0.0345 |
Weighted residual factors for significantly intense reflections | 0.0632 |
Weighted residual factors for all reflections included in the refinement | 0.0715 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.942 |
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/4067922.html
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