Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7062201
Preview
Coordinates | 7062201.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 2-((E)-(p-tolylimino)methyl)-4-nitrophenol |
---|---|
Chemical name | 2-((E)-(p-tolylimino)methyl)-4-nitrophenol |
Formula | C14 H12 N2 O3 |
Calculated formula | C14 H12 N2 O3 |
Title of publication | Photo-and thermoresponsive N-salicylideneaniline derivatives: solid-state studies and structural aspects |
Authors of publication | Hulushe, Siya T.; Malan, Frederick P.; Hosten, Eric C.; Lobb, Kevin A.; Khanye, Setshaba D.; Watkins, Gareth M. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2022 |
Journal volume | 46 |
Journal issue | 43 |
Pages of publication | 20940 - 20950 |
a | 14.0772 ± 0.0011 Å |
b | 14.1814 ± 0.0012 Å |
c | 6.2335 ± 0.0005 Å |
α | 90° |
β | 95.379 ± 0.004° |
γ | 90° |
Cell volume | 1238.94 ± 0.17 Å3 |
Cell temperature | 230 ± 2 K |
Ambient diffraction temperature | 230 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0693 |
Residual factor for significantly intense reflections | 0.0494 |
Weighted residual factors for significantly intense reflections | 0.1374 |
Weighted residual factors for all reflections included in the refinement | 0.1598 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7062201.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.