Information card for entry 2017171
Common name |
stilbene |
Chemical name |
1,2,3-Trimethoxy-4-[(<i>E</i>)-2-phenylvinyl]benzene |
Formula |
C17 H18 O3 |
Calculated formula |
C17 H18 O3 |
SMILES |
c1(ccc(c(c1OC)OC)OC)/C=C/c1ccccc1 |
Title of publication |
1,2,3-Trimethoxy-4-[(<i>E</i>)-2-phenylvinyl]benzene and (<i>E</i>,<i>E</i>)-1,4-bis(2,3,4-trimethoxyphenyl)buta-1,3-diene |
Authors of publication |
Sopková-de Oliveira Santos, Jana; Bazin, Marc-Antoine; Lohier, Jean-François; El Kihel, Laīla; Rault, Sylvain |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
2009 |
Journal volume |
65 |
Journal issue |
7 |
Pages of publication |
o311 - o313 |
a |
10.7138 ± 0.0007 Å |
b |
7.1069 ± 0.0005 Å |
c |
19.8033 ± 0.0013 Å |
α |
90° |
β |
104.76 ± 0.003° |
γ |
90° |
Cell volume |
1458.1 ± 0.17 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
3 |
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 |
0.0467 |
Residual factor for significantly intense reflections |
0.038 |
Weighted residual factors for significantly intense reflections |
0.1115 |
Weighted residual factors for all reflections included in the refinement |
0.1217 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.07 |
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/2017171.html