Information card for entry 1550568
Chemical name |
Diethyl 3,3'-[(4-fluorophenyl)methylidene]bis(1<i>H</i>-indole-2-carboxylate) |
Formula |
C29 H25 F N2 O4 |
Calculated formula |
C29 H25 F N2 O4 |
SMILES |
Fc1ccc(C(c2c3ccccc3[nH]c2C(=O)OCC)c2c3ccccc3[nH]c2C(=O)OCC)cc1 |
Title of publication |
Diethyl 3,3'-[(4-fluorophenyl)methylidene]bis(1<i>H</i>-indole-2-carboxylate) |
Authors of publication |
Li, Yu-Long; Zhou, Jin; Zhong, Kai-Long; Shi, Xing-Hao; Zhang, Zhi-Yuan; Jiang, Hong; Sun, Hong-Shun |
Journal of publication |
IUCrData |
Year of publication |
2019 |
Journal volume |
4 |
Journal issue |
2 |
Pages of publication |
x190134 |
a |
9.959 ± 0.002 Å |
b |
10.49 ± 0.002 Å |
c |
23.62 ± 0.005 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
2467.6 ± 0.9 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
5 |
Space group number |
19 |
Hermann-Mauguin space group symbol |
P 21 21 21 |
Hall space group symbol |
P 2ac 2ab |
Residual factor for all reflections |
0.1395 |
Residual factor for significantly intense reflections |
0.0573 |
Weighted residual factors for significantly intense reflections |
0.0791 |
Weighted residual factors for all reflections included in the refinement |
0.0999 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.954 |
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/1550568.html