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Information card for entry 4067789
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4067789.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H20 N2 O2 Pt |
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Calculated formula | C25 H20 N2 O2 Pt |
SMILES | [Pt]12(c3c(c4[n]1c(cc(c4)C(=O)OCC)c1c2cccc1)cccc3)[n]1ccccc1 |
Title of publication | New C∧N∧C Bis-Cyclometalated Platinum(II) Complexes: Synthesis, Structures, and Photophysical Properties |
Authors of publication | Fuertes, Sara; Brayshaw, Simon K.; Raithby, Paul R.; Schiffers, Stephanie; Warren, Mark R. |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 1 |
Pages of publication | 105 |
a | 12.4337 ± 0.0001 Å |
b | 16.8711 ± 0.0001 Å |
c | 19.1912 ± 0.0001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4025.74 ± 0.05 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0429 |
Residual factor for significantly intense reflections | 0.0271 |
Weighted residual factors for significantly intense reflections | 0.0762 |
Weighted residual factors for all reflections included in the refinement | 0.0797 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.993 |
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/4067789.html
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Users of the data should acknowledge the original authors of the
structural data.