Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7245049
Preview
| Coordinates | 7245049.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | C5H6NSbI4 |
|---|---|
| Formula | C5 H6 I4 N Sb |
| Calculated formula | C5 H6 I4 N Sb |
| Title of publication | Insight on noncovalent interactions and orbital constructs in low-dimensional antimony halide perovskites |
| Authors of publication | Nicholas, Aaron D.; Garman, Leah C.; Albano, Nicolina; Cahill, Chris |
| Journal of publication | Physical Chemistry Chemical Physics |
| Year of publication | 2022 |
| a | 12.62 ± 0.005 Å |
| b | 13.647 ± 0.008 Å |
| c | 8.046 ± 0.003 Å |
| α | 90° |
| β | 95.692 ± 0.016° |
| γ | 90° |
| Cell volume | 1378.9 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0511 |
| Residual factor for significantly intense reflections | 0.0467 |
| Weighted residual factors for significantly intense reflections | 0.1153 |
| Weighted residual factors for all reflections included in the refinement | 0.1169 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.249 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275952 (current) | 2022-06-10 | cif/ Adding structures of 7245048, 7245049, 7245050, 7245051, 7245052, 7245053, 7245054, 7245055 via cif-deposit CGI script. |
7245049.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.