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Information card for entry 2243736
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| Coordinates | 2243736.cif |
|---|---|
| Structure factors | 2243736.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-<i>N</i>-(4-Methoxyphenyl)-2[4-(3-oxo-3-phenylprop-1-en-1-yl)phenoxy]acetamide |
|---|---|
| Formula | C24 H21 N O4 |
| Calculated formula | C24 H21 N O4 |
| SMILES | c1(ccc(cc1)OCC(=O)Nc1ccc(cc1)OC)/C=C/C(=O)c1ccccc1 |
| Title of publication | Synthesis and structure of (<i>E</i>)-<i>N</i>-(4-methoxyphenyl)-2-[4-(3-oxo-3-phenylprop-1-en-1-yl)phenoxy]acetamide |
| Authors of publication | Nguyen Tien, Cong; Vu Quoc, Trung; Nguyen Dang, Dat; Le Duc, Giang; Van Meervelt, Luc |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 2 |
| Pages of publication | 184 - 189 |
| a | 20.3693 ± 0.0009 Å |
| b | 10.0956 ± 0.0004 Å |
| c | 39.1991 ± 0.0016 Å |
| α | 90° |
| β | 98.443 ± 0.004° |
| γ | 90° |
| Cell volume | 7973.6 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 9 |
| Hermann-Mauguin space group symbol | C 1 c 1 |
| Hall space group symbol | C -2yc |
| Residual factor for all reflections | 0.0586 |
| Residual factor for significantly intense reflections | 0.0451 |
| Weighted residual factors for significantly intense reflections | 0.1171 |
| Weighted residual factors for all reflections included in the refinement | 0.1271 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 261318 (current) | 2021-01-30 | cif/ hkl/ Adding structures of 2243736 via cif-deposit CGI script. |
2243736.cif 2243736.hkl |
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Users of the data should acknowledge the original authors of the
structural data.