Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1568835
Preview
Coordinates | 1568835.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C35 H39 Au N3 |
---|---|
Calculated formula | C35 H39 Au N3 |
Title of publication | Exploring Au(i) involving halogen bonding with N-heterocyclic carbene Au(i) aryl complexes in crystalline media |
Authors of publication | Mikherdov, Alexander S.; Jin, Mingoo; Ito, Hajime |
Journal of publication | Chemical Science |
Year of publication | 2023 |
Journal volume | 14 |
Journal issue | 17 |
Pages of publication | 4485 - 4494 |
a | 8.2965 ± 0.0002 Å |
b | 11.9629 ± 0.0003 Å |
c | 16.0732 ± 0.0003 Å |
α | 89.314 ± 0.002° |
β | 78.497 ± 0.002° |
γ | 87.861 ± 0.002° |
Cell volume | 1562.12 ± 0.06 Å3 |
Cell temperature | 123 K |
Ambient diffraction temperature | 123 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0461 |
Residual factor for significantly intense reflections | 0.0444 |
Weighted residual factors for significantly intense reflections | 0.1145 |
Weighted residual factors for all reflections included in the refinement | 0.116 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.0401 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/1568835.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.