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Information card for entry 7015848
Preview
| Coordinates | 7015848.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H25 Cl3 I2 N2 O4 Pt |
|---|---|
| Calculated formula | C26 H25 Cl3 I2 N2 O4 Pt |
| Title of publication | Cyclometalated Pt(iv) trans-diiodo adducts: experimental and computational studies within an homologous series of compounds. |
| Authors of publication | La Deda, Massimo; Crispini, Alessandra; Aiello, Iolinda; Ghedini, Mauro; Amati, Mario; Belviso, Sandra; Lelj, Francesco |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 19 |
| Pages of publication | 5259 - 5270 |
| a | 10.2009 ± 0.0014 Å |
| b | 11.321 ± 0.0015 Å |
| c | 14.245 ± 0.002 Å |
| α | 95.345 ± 0.008° |
| β | 105.473 ± 0.008° |
| γ | 93.856 ± 0.008° |
| Cell volume | 1571.3 ± 0.4 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1414 |
| Residual factor for significantly intense reflections | 0.0617 |
| Weighted residual factors for significantly intense reflections | 0.1662 |
| Weighted residual factors for all reflections included in the refinement | 0.2003 |
| 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 | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176432 (current) | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
7015848.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. |
7015848.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015848.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015848.cif |
| 21364 | 2011-06-22 | ../uploads/cif-deposit/cod/cif Adding structures of 7015848 via cif-deposit CGI script. |
7015848.cif |
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Users of the data should acknowledge the original authors of the
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