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Information card for entry 7026689
Preview
| Coordinates | 7026689.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H6 F2 Mn4 O12 |
|---|---|
| Calculated formula | C18 H6 F2 Mn4 O12 |
| Title of publication | Four new coordination polymers constructed from benzene tricarboxylic acid: synthesis, crystal structure, thermal and magnetic properties. |
| Authors of publication | Nadeem, Muhammad Arif; Bhadbhade, Mohan; Stride, John Arron |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2010 |
| Journal volume | 39 |
| Journal issue | 41 |
| Pages of publication | 9860 - 9865 |
| a | 10.7409 ± 0.0007 Å |
| b | 19.2474 ± 0.0012 Å |
| c | 5.212 ± 0.0003 Å |
| α | 90° |
| β | 115.581 ± 0.002° |
| γ | 90° |
| Cell volume | 971.88 ± 0.11 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0227 |
| Residual factor for significantly intense reflections | 0.0201 |
| Weighted residual factors for significantly intense reflections | 0.0677 |
| Weighted residual factors for all reflections included in the refinement | 0.0727 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.644 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198633 (current) | 2017-07-11 | cod/ (melanie@ameba.ibt.lt) Correcting the '_refine_ls_hydrogen_treatment' data item 'constr' enumeration values with the help of the cif_fix_values script from the cod-tools package revision 5455. The following command was used : cif_fix_values --fix-misspelled src/cod-tools/trunk/data/replacement-values/replacement_values.lst $i | cif_filter --no-exclude-publication-details -h $i | sponge $i A total of 700 files were changed. |
7026689.cif |
| 179972 | 2016-03-25 | cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/66. |
7026689.cif |
| 93564 | 2014-01-13 | cif/ Adding structures of 7026688, 7026689, 7026690, 7026691 via cif-deposit CGI script. |
7026689.cif |
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Users of the data should acknowledge the original authors of the
structural data.