Information card for entry 2231432
Chemical name |
<i>N</i>,<i>N</i>'-Bis(2,3-dimethoxybenzylidene)ethane-1,2-diamine |
Formula |
C20 H24 N2 O4 |
Calculated formula |
C20 H24 N2 O4 |
SMILES |
COc1c(cccc1OC)/C=N/CC/N=C/c1cccc(c1OC)OC |
Title of publication |
<i>N</i>,<i>N</i>'-Bis(2,3-dimethoxybenzylidene)ethane-1,2-diamine |
Authors of publication |
Xue, Hua; Li, Wenjuan; Han, Hongfei |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2011 |
Journal volume |
67 |
Journal issue |
9 |
Pages of publication |
o2431 |
a |
5.0491 ± 0.0005 Å |
b |
13.5803 ± 0.0015 Å |
c |
13.5803 ± 0.0015 Å |
α |
89.866 ± 0.002° |
β |
88.863 ± 0.001° |
γ |
88.863 ± 0.001° |
Cell volume |
930.81 ± 0.17 Å3 |
Cell temperature |
298 ± 2 K |
Ambient diffraction temperature |
298 ± 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 |
0.1106 |
Residual factor for significantly intense reflections |
0.0619 |
Weighted residual factors for significantly intense reflections |
0.1506 |
Weighted residual factors for all reflections included in the refinement |
0.1838 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.041 |
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/2231432.html