Information card for entry 2239018
Chemical name |
<i>N</i>-Phenyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylidene)hydrazinecarbothioamide |
Formula |
C17 H17 N3 S |
Calculated formula |
C17 H17 N3 S |
SMILES |
S=C(Nc1ccccc1)N/N=C1\CCCc2c1cccc2 |
Title of publication |
<i>N</i>-Phenyl-2-(1,2,3,4-tetrahydronaphthalen-1-ylidene)hydrazinecarbothioamide |
Authors of publication |
de Oliveira, Adriano Bof; Feitosa, Bárbara Regina Santos; Näther, Christian; Jess, Inke |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2014 |
Journal volume |
70 |
Journal issue |
2 |
Pages of publication |
o205 |
a |
8.4415 ± 0.0003 Å |
b |
18.0256 ± 0.0007 Å |
c |
10.026 ± 0.0003 Å |
α |
90° |
β |
107.495 ± 0.002° |
γ |
90° |
Cell volume |
1455.02 ± 0.09 Å3 |
Cell temperature |
200 ± 2 K |
Ambient diffraction temperature |
200 ± 2 K |
Number of distinct elements |
4 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/n 1 |
Hall space group symbol |
-P 2yn |
Residual factor for all reflections |
0.0454 |
Residual factor for significantly intense reflections |
0.0358 |
Weighted residual factors for significantly intense reflections |
0.0847 |
Weighted residual factors for all reflections included in the refinement |
0.0889 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.05 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2239018.html