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Information card for entry 7205231
Preview
| Coordinates | 7205231.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C39 H34 N4 O13 S Zn2 |
|---|---|
| Calculated formula | C39 H34 N4 O13 S Zn2 |
| Title of publication | Coordination polymers of flexible tetracarboxylic acids with metal ions. II. Supramolecular assemblies of 5,5′-methylene- and 5,5′-(ethane-1,2-diyl)-bis(oxy)diisophthalic acid ligands with d-transition metals |
| Authors of publication | Karmakar, Anirban; Goldberg, Israel |
| Journal of publication | CrystEngComm |
| Year of publication | 2011 |
| Journal volume | 13 |
| Journal issue | 1 |
| Pages of publication | 350 |
| a | 16.437 ± 0.0002 Å |
| b | 14.699 ± 0.0002 Å |
| c | 17.5061 ± 0.0002 Å |
| α | 90° |
| β | 109.379 ± 0.001° |
| γ | 90° |
| Cell volume | 3989.97 ± 0.09 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0882 |
| Residual factor for significantly intense reflections | 0.0493 |
| Weighted residual factors for significantly intense reflections | 0.1277 |
| Weighted residual factors for all reflections included in the refinement | 0.1417 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.943 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180383 (current) | 2016-03-26 | cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/52. |
7205231.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205231.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205231.cif |
| 14580 | 2011-03-11 | ../uploads/cif-deposit/cod/cif Adding structures of 7205222, 7205223, 7205224, 7205225, 7205226, 7205227, 7205228, 7205229, 7205230, 7205231, 7205232, 7205233, 7205234 via cif-deposit CGI script. |
7205231.cif |
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Users of the data should acknowledge the original authors of the
structural data.