Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4086906
Preview
Coordinates | 4086906.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | no |
---|---|
Formula | C46 H58 N4 Pt2 |
Calculated formula | C46 H58 N4 Pt2 |
SMILES | [Pt]12([N](=C(C(/C=C/C3C(C)=[N]([Pt]4([N]=3c3c(C)cccc3C)([CH2]=[CH2]4)C)c3c(cccc3C)C)=[N]1c1c(C)cccc1C)C)c1c(C)cccc1C)(C)[CH2]=[CH2]2 |
Title of publication | Oxidative Coupling of Imino, Amide Platinum(II) Complexes Yields Highly Conjugated Blue Dimers |
Authors of publication | Esposito, Roberto; Calvanese, Luisa; Cucciolito, Maria Elena; D’Auria, Gabriella; Falcigno, Lucia; Fiorini, Valentina; Pezzella, Prisco; Roviello, Giuseppina; Stagni, Stefano; Talarico, Giovanni; Ruffo, Francesco |
Journal of publication | Organometallics |
Year of publication | 2017 |
Journal volume | 36 |
Journal issue | 2 |
Pages of publication | 384 |
a | 14.695 ± 0.001 Å |
b | 20.92 ± 0.003 Å |
c | 14.748 ± 0.001 Å |
α | 90° |
β | 113.27 ± 0.02° |
γ | 90° |
Cell volume | 4165 ± 1 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0733 |
Residual factor for significantly intense reflections | 0.035 |
Weighted residual factors for significantly intense reflections | 0.0526 |
Weighted residual factors for all reflections included in the refinement | 0.0599 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.978 |
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/4086906.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.