Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4326196
Preview
Coordinates | 4326196.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H28 F12 N14 P2 Pt2 |
---|---|
Calculated formula | C28 H28 F12 N14 P2 Pt2 |
SMILES | [Pt]123[n]4n5[Pt]6([n]7c(N8C=6N(Cc5cc4C)C=C8)nccc7)[n]4n1c(cc4C)CN1C=3N(C=C1)c1[n]2cccn1.[P](F)(F)(F)(F)(F)[F-].[P](F)(F)(F)(F)(F)[F-].N#CC.N#CC |
Title of publication | Synthesis and Characterization of Nickel Inverse 9-Metallacrown-3, Palladium-Silver, and Dinuclear Platinum Complexes Containing Pyrazole-Functionalized NHC Ligands |
Authors of publication | Chao Chen; Huayu Qiu; Wanzhi Chen |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 8671 - 8678 |
a | 9.7764 ± 0.0009 Å |
b | 12.1843 ± 0.0016 Å |
c | 16.3997 ± 0.0019 Å |
α | 74.906 ± 0.001° |
β | 86.77 ± 0.002° |
γ | 81.01 ± 0.001° |
Cell volume | 1862.7 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0868 |
Residual factor for significantly intense reflections | 0.0495 |
Weighted residual factors for significantly intense reflections | 0.1158 |
Weighted residual factors for all reflections included in the refinement | 0.1396 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
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/4326196.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.