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Information card for entry 7235716
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| Coordinates | 7235716.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | {Cu2(HTyr-N-Dan)4(H2O)2].2(H2O) |
|---|---|
| Formula | C84 H92 Cu2 N8 O24 S4 |
| Calculated formula | C84 H84 Cu2 N8 O24 S4 |
| Title of publication | A homochiral luminescent compound with four-fold symmetry as a potential chemosensor for nitroanilines |
| Authors of publication | Kumar, Navnita; Khullar, Sadhika; Mandal, Sanjay K. |
| Journal of publication | RSC Adv. |
| Year of publication | 2014 |
| Journal volume | 4 |
| Journal issue | 88 |
| Pages of publication | 47249 |
| a | 20.3483 ± 0.0008 Å |
| b | 20.3483 ± 0.0008 Å |
| c | 11.0831 ± 0.0005 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4589 ± 0.3 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 79 |
| Hermann-Mauguin space group symbol | I 4 |
| Hall space group symbol | I 4 |
| Residual factor for all reflections | 0.077 |
| Residual factor for significantly intense reflections | 0.054 |
| Weighted residual factors for significantly intense reflections | 0.1467 |
| Weighted residual factors for all reflections included in the refinement | 0.1693 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | Mokα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233248 (current) | 2019-11-23 | cif/ Adding structures of 7235716 via cif-deposit CGI script. |
7235716.cif |
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