Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4345657
Preview
| Coordinates | 4345657.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | La3TiBi5 |
|---|---|
| Chemical name | La3TiBi5 |
| Formula | Bi5 La3 Ti |
| Calculated formula | Bi5 La3 Ti |
| Title of publication | Hypervalent Bismuthides La3MBi5 (M = Ti, Zr, Hf) and Related Antimonides: Absence of Superconductivity |
| Authors of publication | Murakami, Taito; Yamamoto, Takafumi; Takeiri, Fumitaka; Nakano, Kousuke; Kageyama, Hiroshi |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2017 |
| a | 9.69876 ± 0.00006 Å |
| b | 9.69876 ± 0.00006 Å |
| c | 6.46447 ± 0.00006 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 526.618 ± 0.007 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 3 |
| Space group number | 193 |
| Hermann-Mauguin space group symbol | P 63/m c m |
| Hall space group symbol | -P 6c 2 |
| Residual factor for all reflections | 0.0595 |
| Residual factor for significantly intense reflections | 0.0411 |
| Weighted residual factors for all reflections | 0.0436 |
| Weighted residual factors for significantly intense reflections | 0.0405 |
| Goodness-of-fit parameter for all reflections | 2.09 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.41987 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 195310 (current) | 2017-04-11 | cif/ Adding structures of 4345657, 4345658, 4345659 via cif-deposit CGI script. |
4345657.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.