Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2312055
Preview
| Coordinates | 2312055.cif |
|---|---|
| Structure factors | 2312055.hkl |
| Original IUCr paper | HTML |
| Chemical name | (±,E)-<i>N</i>'-[5,7-Dihydroxy-2-(4-hydroxyphenyl)chroman-4-ylidene]-2-(naphthalen-1-yl)acetohydrazide ethyl acetate monosolvate |
|---|---|
| Formula | C31 H30 N2 O7 |
| Calculated formula | C31 H30 N2 O7 |
| Title of publication | Crystal structures of three newly synthesized flavanone hydrazones. |
| Authors of publication | Yennawar, Hemant P.; Sigmon, Anna; Margulis, Eleanora |
| Journal of publication | Acta crystallographica. Section E, Crystallographic communications |
| Year of publication | 2023 |
| Journal volume | 79 |
| Journal issue | Pt 3 |
| Pages of publication | 236 - 240 |
| a | 9.221 ± 0.0005 Å |
| b | 12.1902 ± 0.0008 Å |
| c | 13.4982 ± 0.0007 Å |
| α | 94.413 ± 0.005° |
| β | 95.172 ± 0.004° |
| γ | 111.561 ± 0.005° |
| Cell volume | 1395.4 ± 0.15 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0908 |
| Residual factor for significantly intense reflections | 0.0615 |
| Weighted residual factors for significantly intense reflections | 0.1799 |
| Weighted residual factors for all reflections included in the refinement | 0.2115 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 282419 (current) | 2023-04-05 | cif/ hkl/ Adding structures of 2312055, 2312056, 2312057 via cif-deposit CGI script. |
2312055.cif 2312055.hkl |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.