Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4113064
Preview
Coordinates | 4113064.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | itq21_calcined |
---|---|
Chemical name | structure solved from laboratory powder diffraction data |
Formula | Ge14.83 O71.64 Si20.82 |
Calculated formula | Ge14.832 O71.64 Si20.816 |
Title of publication | Synthesis, Characterization, and Framework Heteroatom Localization in ITQ-21 |
Authors of publication | Teresa Blasco; Avelino Corma; Maria José Díaz-Cabañas; Fernando Rey; Jordi Rius; German Sastre; José A. Vidal-Moya |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2004 |
Journal volume | 126 |
Pages of publication | 13414 - 13423 |
a | 13.691 ± 0.002 Å |
b | 13.691 ± 0.002 Å |
c | 13.691 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2566.3 ± 0.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 221 |
Hermann-Mauguin space group symbol | P m -3 m |
Hall space group symbol | -P 4 2 3 |
Residual factor for all reflections | 0.059 |
Residual factor for significantly intense reflections | 0.059 |
Weighted residual factors for all reflections | 0.073 |
Weighted residual factors for significantly intense reflections | 0.073 |
Goodness-of-fit parameter for all reflections | 2.7 |
Goodness-of-fit parameter for significantly intense reflections | 2.7 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54059 Å |
Diffraction radiation type | CuKa12 |
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/4113064.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.