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Information card for entry 2021716
Preview
| Coordinates | 2021716.cif |
|---|---|
| Structure factors | 2021716.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[[[aquacadmium(II)]-bis(μ-4b,5,7,7a-tetrahydro-4b,7a-epiminomethanoimino-6<i>H</i>-imidazo[4,5-<i>f</i>][1,10]phenanthroline-6,13-dione)] bis(perchlorate) dihydrate] |
|---|---|
| Formula | C28 H26 Cd Cl2 N12 O15 |
| Calculated formula | C28 H26 Cd Cl2 N12 O15 |
| Title of publication | Coordination polymers of Cd^II^ and Pb^II^ derived from bipyridine‒glycoluril: influence of metal-ion size and counter-ions |
| Authors of publication | Tayade, Sakharam B.; Markad, Datta; Kumbhar, Avinash S.; Erxleben, Andrea; Chakravarty, Debamitra |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2019 |
| Journal volume | 75 |
| Journal issue | 8 |
| a | 15.146 ± 0.003 Å |
| b | 12.2411 ± 0.0011 Å |
| c | 17.6555 ± 0.0016 Å |
| α | 90° |
| β | 99.104 ± 0.002° |
| γ | 90° |
| Cell volume | 3232.2 ± 0.8 Å3 |
| Cell temperature | 293.15 K |
| Ambient diffraction temperature | 293.15 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/a 1 |
| Hall space group symbol | -I 2ya |
| Residual factor for all reflections | 0.0288 |
| Residual factor for significantly intense reflections | 0.0256 |
| Weighted residual factors for significantly intense reflections | 0.0616 |
| Weighted residual factors for all reflections included in the refinement | 0.0638 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.109 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216918 (current) | 2019-07-10 | cif/ hkl/ Adding structures of 2021716, 2021717 via cif-deposit CGI script. |
2021716.cif 2021716.hkl |
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Users of the data should acknowledge the original authors of the
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