Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4323432
Preview
Coordinates | 4323432.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H33 Ag N2 P2 S2 |
---|---|
Calculated formula | C40 H33 Ag N2 P2 S2 |
SMILES | [Ag]1([S]=C(S1)n1nccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Silver(I) Pyrazolates. Synthesis and X-ray and 31P-NMR Characterization of Triphenylphosphine Complexes and Their Reactivity toward Heterocumulenes |
Authors of publication | G. Attilio Ardizzoia; Girolamo La Monica; Angelo Maspero; Massimo Moret; Norberto Masciocchi |
Journal of publication | Inorganic Chemistry |
Year of publication | 1997 |
Journal volume | 36 |
Pages of publication | 2321 - 2328 |
a | 10.329 ± 0.004 Å |
b | 13.082 ± 0.002 Å |
c | 14.284 ± 0.003 Å |
α | 86.71 ± 0.02° |
β | 75.14 ± 0.02° |
γ | 74.79 ± 0.02° |
Cell volume | 1800.1 ± 0.9 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.046 |
Residual factor for significantly intense reflections | 0.0279 |
Weighted residual factors for all reflections | 0.0767 |
Weighted residual factors for significantly intense reflections | 0.0702 |
Goodness-of-fit parameter for all reflections | 1.035 |
Goodness-of-fit parameter for significantly intense reflections | 1.051 |
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/4323432.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.