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Information card for entry 7243413
Preview
| Coordinates | 7243413.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C40 H28 N2 O4 |
|---|---|
| Calculated formula | C40 H28 N2 O4 |
| Title of publication | Schiff base ligands derived from 1,2-bis(2′-nitro-/amino-phenoxy)-3-R-benzene and 2-hydroxy-1-naphthaldehyde and their Cu/Zn(ii) complexes: synthesis, characterization, X-ray structures and computational studies |
| Authors of publication | Aryaeifar, Mahnaz; Amiri Rudbari, Hadi; Blacque, Olivier; Islam, Mohammad Khairul; Scopelliti, Rosario; Braun, Jason D.; Herbert, David E.; Bruno, Giuseppe; Janiak, Christoph; Enamullah, Mohammed |
| Journal of publication | CrystEngComm |
| Year of publication | 2021 |
| Journal volume | 23 |
| Journal issue | 36 |
| Pages of publication | 6322 - 6339 |
| a | 14.023 ± 0.003 Å |
| b | 15.366 ± 0.003 Å |
| c | 14.628 ± 0.003 Å |
| α | 90° |
| β | 109.68 ± 0.03° |
| γ | 90° |
| Cell volume | 2967.9 ± 1.2 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0543 |
| Residual factor for significantly intense reflections | 0.0364 |
| Weighted residual factors for significantly intense reflections | 0.0956 |
| Weighted residual factors for all reflections included in the refinement | 0.1008 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 269674 (current) | 2021-10-06 | cif/ Updating files of 7243407, 7243408, 7243409, 7243410, 7243411, 7243412, 7243413 Original log message: Adding full bibliography for 7243407--7243413.cif. |
7243413.cif |
| 268171 | 2021-08-24 | cif/ Adding structures of 7243407, 7243408, 7243409, 7243410, 7243411, 7243412, 7243413 via cif-deposit CGI script. |
7243413.cif |
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Users of the data should acknowledge the original authors of the
structural data.