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Information card for entry 2242081
Preview
Coordinates | 2242081.cif |
---|---|
Structure factors | 2242081.hkl |
Original IUCr paper | HTML |
Chemical name | (2<i>Z</i>,5<i>Z</i>)-3-(2-Methoxyphenyl)-2-[(2-methoxyphenyl)imino]-5-(4-nitrobenzylidene)thiazolidin-4-one |
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Formula | C24 H19 N3 O5 S |
Calculated formula | C24 H19 N3 O5 S |
SMILES | S1C(=C\c2ccc(N(=O)=O)cc2)/C(=O)N(/C1=N/c1c(OC)cccc1)c1c(OC)cccc1 |
Title of publication | Crystal and molecular structure of (2<i>Z</i>,5<i>Z</i>)-3-(2-methoxyphenyl)-2-[(2-methoxyphenyl)imino]-5-(4-nitrobenzylidene)thiazolidin-4-one |
Authors of publication | Djafri, Ahmed; Chouaih, Abdelkader; Daran, Jean-Claude; Djafri, Ayada; Hamzaoui, Fodil |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2017 |
Journal volume | 73 |
Journal issue | 4 |
Pages of publication | 511 - 514 |
a | 15.6096 ± 0.0004 Å |
b | 8.8817 ± 0.0002 Å |
c | 15.8973 ± 0.0004 Å |
α | 90° |
β | 98.601 ± 0.002° |
γ | 90° |
Cell volume | 2179.21 ± 0.09 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0565 |
Residual factor for significantly intense reflections | 0.0406 |
Weighted residual factors for significantly intense reflections | 0.0971 |
Weighted residual factors for all reflections included in the refinement | 0.1066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2242081.html
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