Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2014146
Preview
Coordinates | 2014146.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | μ-Biphenyl-2,2'-dithiolato-κ^2^S:S'bis[(triphenylphosphine-κP)gold(I)] |
---|---|
Formula | C48 H38 Au2 P2 S2 |
Calculated formula | C48 H38 Au2 P2 S2 |
SMILES | [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)Sc1ccccc1c1ccccc1S[Au][P](c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | μ-Biphenyl-2,2'-dithiolato-κ^2^<i>S</i>:<i>S</i>'-bis[(triphenylphosphine-κ<i>P</i>)gold(I)] |
Authors of publication | Scott A. Larkin; Jeanette A. Krause Bauer; V. E. Konoplev; Victor P. Dyadchenko; Dmitrii A. Lemenovskii; Mitchell R. M. Bruce; Alice E. Bruce |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 2004 |
Journal volume | 60 |
Journal issue | 9 |
Pages of publication | m440 - m442 |
a | 20.031 ± 0.0004 Å |
b | 10.2199 ± 0.0002 Å |
c | 20.0399 ± 0.0003 Å |
α | 90° |
β | 96.303 ± 0.002° |
γ | 90° |
Cell volume | 4077.67 ± 0.13 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0708 |
Residual factor for significantly intense reflections | 0.0365 |
Weighted residual factors for significantly intense reflections | 0.0621 |
Weighted residual factors for all reflections included in the refinement | 0.071 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
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/2014146.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.