Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2023535
Preview
Coordinates | 2023535.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Bis(4-methylpiperidinium) tetrabromidoaurate(III) bromide |
---|---|
Formula | C12 H28 Au Cl5 N2 |
Calculated formula | C12 H28 Au Cl5 N2 |
Title of publication | Crystal structures of three 4-methylpiperidinium salts (one as three polymorphs) with tetrahalogenidoaurate(III), halide and (in one case) dichloroiodate(I) counter-anions |
Authors of publication | Döring, Cindy; Jones, Peter G. |
Journal of publication | Acta Crystallographica Section E Crystallographic Communications |
Year of publication | 2025 |
Journal volume | 81 |
Journal issue | 7 |
a | 11.9196 ± 0.0004 Å |
b | 8.5545 ± 0.0003 Å |
c | 19.9052 ± 0.0007 Å |
α | 90° |
β | 102.955 ± 0.004° |
γ | 90° |
Cell volume | 1978 ± 0.12 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0418 |
Residual factor for significantly intense reflections | 0.0272 |
Weighted residual factors for significantly intense reflections | 0.0474 |
Weighted residual factors for all reflections included in the refinement | 0.0513 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
300221 (current) | 2025-06-26 | cif/ Adding structures of 2023534, 2023535, 2023536, 2023537, 2023538 via cif-deposit CGI script. |
2023535.cif |
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.