Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7015923
Preview
Coordinates | 7015923.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C31 H53 Cl2 N7 O5 Pd |
---|---|
Calculated formula | C29 H47 Cl2 N7 O4 Pd |
SMILES | [Pd]12(Cl)[n]3c(cccc3C[N]2=C2N(C=CN2C(C)(C)C)C(C)(C)C)C[N]1=C1N(C=CN1C(C)(C)C)C(C)(C)C.Cl(=O)(=O)(=O)[O-] |
Title of publication | Equilibrium studies of the reactions of palladium(ii) bis(imidazolin-2-imine) complexes with biologically relevant nucleophiles. The crystal structures of [(TL(tBu))PdCl]ClO(4) and [(BL(iPr))PdCl(2)]. |
Authors of publication | Bogojeski, Jovana; Jelić, Ratomir; Petrović, Dejan; Herdtweck, Eberhardt; Jones, Peter G.; Tamm, Matthias; Bugarčić, Zivadin D |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2011 |
Journal volume | 40 |
Journal issue | 24 |
Pages of publication | 6515 - 6523 |
a | 9.0962 ± 0.0002 Å |
b | 13.0994 ± 0.0003 Å |
c | 29.6124 ± 0.0006 Å |
α | 90° |
β | 96.852 ± 0.002° |
γ | 90° |
Cell volume | 3503.26 ± 0.13 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 | 0.0878 |
Residual factor for significantly intense reflections | 0.0443 |
Weighted residual factors for significantly intense reflections | 0.096 |
Weighted residual factors for all reflections included in the refinement | 0.1055 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
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/7015923.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.