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Information card for entry 4067317
Preview
Coordinates | 4067317.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H27 B F4 N4 O Pt |
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Calculated formula | C22 H27 B F4 N4 O Pt |
SMILES | [Pt]12([N]#CC)(=C3N(C=CN3c3ccccc3C#N)C)[CH]3=[CH]1CC[C@@H](OC)[C@H]2CC3.[B](F)(F)(F)[F-].[Pt]12([N]#CC)(=C3N(C=CN3c3ccccc3C#N)C)[CH]3=[CH]1CC[C@H](OC)[C@@H]2CC3.[B](F)(F)(F)[F-] |
Title of publication | Palladium(II) and Platinum(II) Complexes Featuring a Nitrile-Functionalized N-Heterocyclic Carbene Ligand |
Authors of publication | O, Wylie W. N.; Lough, Alan J.; Morris, Robert H. |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 3 |
Pages of publication | 570 |
a | 8.0398 ± 0.0002 Å |
b | 9.8791 ± 0.0003 Å |
c | 16.6686 ± 0.0005 Å |
α | 95.799 ± 0.0017° |
β | 102.562 ± 0.0018° |
γ | 108.283 ± 0.0016° |
Cell volume | 1206.36 ± 0.06 Å3 |
Cell temperature | 150 ± 1 K |
Ambient diffraction temperature | 150 ± 1 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 | 0.0519 |
Residual factor for significantly intense reflections | 0.0376 |
Weighted residual factors for significantly intense reflections | 0.0777 |
Weighted residual factors for all reflections included in the refinement | 0.0832 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.123 |
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/4067317.html
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Users of the data should acknowledge the original authors of the
structural data.