Information card for entry 2013815
| Common name |
4-{[(2,4-dinitrophenyl)hydrazono]phenylmethyl}benzene-1,3-diol N,N-dimethylacetamide solvate |
| Chemical name |
2,4-dihydroxybenzophenone 2,4-dinitrophenylhydrazone N,N-dimethylformamide solvate |
| Formula |
C23 H23 N5 O7 |
| Calculated formula |
C23 H23 N5 O7 |
| SMILES |
Oc1cc(O)c(cc1)/C(=N/Nc1ccc(N(=O)=O)cc1N(=O)=O)c1ccccc1.O=C(N(C)C)C |
| Title of publication |
2,4-Dinitrophenylhydrazones of 2,4-dihydroxybenzaldehyde, 2,4-dihydroxyacetophenone and 2,4-dihydroxybenzophenone |
| Authors of publication |
Baughman, Russell G.; Martin, Kenneth L.; Singh, Rajendra K.; Stoffer, James O. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
2004 |
| Journal volume |
60 |
| Journal issue |
2 |
| Pages of publication |
o103 - o106 |
| a |
7.8155 ± 0.0009 Å |
| b |
11.549 ± 0.002 Å |
| c |
13.904 ± 0.002 Å |
| α |
100.38 ± 0.01° |
| β |
95.8 ± 0.01° |
| γ |
102.74 ± 0.01° |
| Cell volume |
1191 ± 0.3 Å3 |
| Cell temperature |
293 ± 2 K |
| Ambient diffraction temperature |
293 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.097 |
| Residual factor for significantly intense reflections |
0.057 |
| Weighted residual factors for significantly intense reflections |
0.146 |
| Weighted residual factors for all reflections included in the refinement |
0.171 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
Yes |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/2013815.html