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Information card for entry 7714318
Preview
| Coordinates | 7714318.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C96 H157 Cu6 N34 O41.5 |
|---|---|
| Calculated formula | C96.028 H146.032 Cu6 N34.006 O41.494 |
| Title of publication | Hexa- and octanuclear copper(II) complexes with tetraeicosaaza amine macrocycle |
| Authors of publication | Gregoliński, Janusz; Fedorowicz, Dominka; Ślepokura, Katarzyna; Kłak, Julia; Witwicki, Maciej |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 14.445 ± 0.003 Å |
| b | 14.703 ± 0.003 Å |
| c | 15.916 ± 0.003 Å |
| α | 108.45 ± 0.02° |
| β | 93.03 ± 0.02° |
| γ | 103.86 ± 0.02° |
| Cell volume | 3082.7 ± 1.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0619 |
| Residual factor for significantly intense reflections | 0.0577 |
| Weighted residual factors for significantly intense reflections | 0.1681 |
| Weighted residual factors for all reflections included in the refinement | 0.1717 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287120 (current) | 2023-10-26 | cif/ Adding structures of 7714318, 7714319, 7714320 via cif-deposit CGI script. |
7714318.cif |
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