Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1506387
Preview
| Coordinates | 1506387.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H6 Au3 N6 O3 Tb |
|---|---|
| Calculated formula | C6 H6 Au3 N6 O3 Tb |
| Title of publication | Structure and spectroscopy of Tb[Au(CN)2]3.3H2O. |
| Authors of publication | Tanner, Peter A.; Zhou, Xianju; Wong, Wing-Tak; Kratzer, Cornelius; Yersin, Hartmut |
| Journal of publication | The journal of physical chemistry. B |
| Year of publication | 2005 |
| Journal volume | 109 |
| Journal issue | 27 |
| Pages of publication | 13083 - 13090 |
| a | 6.622 ± 0.001 Å |
| b | 6.622 ± 0.001 Å |
| c | 18.147 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 689.15 ± 0.19 Å3 |
| Cell temperature | 298 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 193 |
| Hermann-Mauguin space group symbol | P 63/m c m |
| Hall space group symbol | -P 6c 2 |
| Residual factor for significantly intense reflections | 0.041 |
| Weighted residual factors for all reflections included in the refinement | 0.045 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| 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. |
1506387.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. |
1506387.cif |
| 120071 | 2014-07-11 | Adding DOIs to range 1 structures. | 1506387.cif |
| 50276 | 2012-03-31 | ../uploads/cif-deposit/cod/cif Adding structures of 1506387 via cif-deposit CGI script. |
1506387.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.