Information card for entry 2234132
Chemical name |
7-Chloro-4-[(<i>E</i>)-2-(3,4,5-trimethoxybenzylidene)hydrazin-1-yl]quinoline |
Formula |
C19 H18 Cl N3 O3 |
Calculated formula |
C19 H18 Cl N3 O3 |
SMILES |
Clc1ccc2c(N/N=C/c3cc(OC)c(OC)c(OC)c3)ccnc2c1 |
Title of publication |
7-Chloro-4-[(<i>E</i>)-2-(3,4,5-trimethoxybenzylidene)hydrazin-1-yl]quinoline |
Authors of publication |
de Ferreira, Marcelle; de Souza, Marcus V. N.; Wardell, Solange M. S. V.; Tiekink, Edward R. T.; Wardell, James L. |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2012 |
Journal volume |
68 |
Journal issue |
4 |
Pages of publication |
o1214 - o1215 |
a |
7.6338 ± 0.0002 Å |
b |
15.5335 ± 0.0004 Å |
c |
28.796 ± 0.0007 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
3414.62 ± 0.15 Å3 |
Cell temperature |
120 ± 2 K |
Ambient diffraction temperature |
120 ± 2 K |
Number of distinct elements |
5 |
Space group number |
61 |
Hermann-Mauguin space group symbol |
P b c a |
Hall space group symbol |
-P 2ac 2ab |
Residual factor for all reflections |
0.0429 |
Residual factor for significantly intense reflections |
0.0355 |
Weighted residual factors for significantly intense reflections |
0.0962 |
Weighted residual factors for all reflections included in the refinement |
0.1008 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.024 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2234132.html