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Information card for entry 7113376
Preview
| Coordinates | 7113376.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C12 H32 Cl4 Fe5 N O33 |
|---|---|
| Calculated formula | C12 Cl4 Fe5 N O33 |
| Title of publication | A novel supramolecular assembly in an iron(III) compound exhibiting magnetic ordering at 70 K |
| Authors of publication | Armentano, Donatella; De Munno, Giovanni; Mastropietro, Teresa F.; Julve, Miguel; Lloret, Francesc |
| Journal of publication | Chemical Communications (Cambridge, United Kingdom) |
| Year of publication | 2004 |
| Journal issue | 10 |
| Pages of publication | 1160 - 1161 |
| a | 27.328 ± 0.006 Å |
| b | 32.125 ± 0.006 Å |
| c | 18.424 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 16175 ± 6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.073 |
| Residual factor for significantly intense reflections | 0.0663 |
| Weighted residual factors for significantly intense reflections | 0.2052 |
| Weighted residual factors for all reflections included in the refinement | 0.212 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.083 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297218 (current) | 2025-01-08 | Updated bibliographic information in entry 7113376. |
7113376.cif |
| 180247 | 2016-03-26 | cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/33. |
7113376.cif |
| 134573 | 2015-04-01 | cod/ (robertas@burundukas) The 'cif_fix_values' script was applied on the CIF files, which had notes in the COD database's table 'validations' generated by the 'cif_validate' validator about misspelling of the enumerable values of the data item '_symmetry_cell_setting'. There was used the option '--fix-only-misspelled'. And there were used 'cif_filter' later in the pipe. Read the log for more details. There were 595 distinct CIF files which had messages from validator. The 'cif_fix_values' script generated 417 messages about corrected misspelled values of enumerators to the log file. Some messages were generated by 'cif_filter' and some changes by the 'cif_filter' were done without messaging to the log file. The 'cif_fix_value' script corrected the enumerators of all data items presented in the file for the replacement of the misspelled values. |
7113376.cif |
| 114609 | 2014-05-28 | cif/ Adding structures of 7113376 via cif-deposit CGI script. |
7113376.cif |
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Users of the data should acknowledge the original authors of the
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