Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4003209
Preview
| Coordinates | 4003209.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C0.17 H0.5 F0.1 N0.04 O2 Si |
|---|---|
| Calculated formula | C0.1666 H0.4998 F0.10325 N0.0416667 O2 Si |
| Title of publication | Facile Synthesis and Catalysis of Pure-Silica and Heteroatom LTA |
| Authors of publication | Boal, Ben W.; Schmidt, Joel E.; Deimund, Mark A.; Deem, Michael W.; Henling, Lawrence M.; Brand, Stephen K.; Zones, Stacey I.; Davis, Mark E. |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2015 |
| Journal volume | 27 |
| Journal issue | 22 |
| Pages of publication | 7774 |
| a | 11.824 ± 0.005 Å |
| b | 11.824 ± 0.005 Å |
| c | 11.824 ± 0.005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1653.1 ± 1.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 6 |
| 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 | 0.0427 |
| Residual factor for significantly intense reflections | 0.0296 |
| Weighted residual factors for significantly intense reflections | 0.075 |
| Weighted residual factors for all reflections included in the refinement | 0.0798 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.123 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231430 (current) | 2019-11-22 | cif/ Adding structures of 4003209 via cif-deposit CGI script. |
4003209.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.