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Information card for entry 7229248
Preview
| Coordinates | 7229248.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Zinc diphosphonate 1,3-diaminopropane |
|---|---|
| Formula | C7 H20 N2 O14 P4 Zn3 |
| Calculated formula | C7 H20 N2 O14 P4 Zn3 |
| Title of publication | Novel Amine Templated Three-Dimensional Zinc-Organophosphonates with Variable Pore-Openings |
| Authors of publication | Paul, Avijit Kumar; Kanagaraj, Rajendiran; Jana, Ajay; Maji, Pradip |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 18.117 ± 0.0004 Å |
| b | 9.8448 ± 0.0003 Å |
| c | 10.7798 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1922.67 ± 0.09 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 60 |
| Hermann-Mauguin space group symbol | P b c n |
| Hall space group symbol | -P 2n 2ab |
| Residual factor for all reflections | 0.0361 |
| Residual factor for significantly intense reflections | 0.0271 |
| Weighted residual factors for significantly intense reflections | 0.0768 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 201290 (current) | 2017-09-26 | cif/ Adding structures of 7229247, 7229248, 7229249, 7229250, 7229251 via cif-deposit CGI script. |
7229248.cif |
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Users of the data should acknowledge the original authors of the
structural data.