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Information card for entry 7205229
Preview
| Coordinates | 7205229.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H12 Ni2 O12 |
|---|---|
| Calculated formula | C18 H12 Ni2 O12 |
| 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 | 10.0777 ± 0.0002 Å |
| b | 11.0012 ± 0.0002 Å |
| c | 15.0573 ± 0.0003 Å |
| α | 72.949 ± 0.0012° |
| β | 77.0468 ± 0.0011° |
| γ | 81.3705 ± 0.001° |
| Cell volume | 1548.98 ± 0.05 Å3 |
| Cell temperature | 110 ± 2 K |
| Ambient diffraction temperature | 110 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0553 |
| Residual factor for significantly intense reflections | 0.0379 |
| Weighted residual factors for significantly intense reflections | 0.096 |
| Weighted residual factors for all reflections included in the refinement | 0.1009 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.933 |
| 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. |
7205229.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7205229.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7205229.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. |
7205229.cif |
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Users of the data should acknowledge the original authors of the
structural data.