Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7111614
Preview
| Coordinates | 7111614.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C31 H35 Co3 O19.5 S2 |
|---|---|
| Calculated formula | C31 H30 Co3 O19.5 S2 |
| Title of publication | Reversible de-/resolvation and accompanied magnetism modulation in a framework of topologically ferrimagnetic [Co3(μ3-OH)2]n chains linked by a V-shaped ligand 4,4′-dicarboxybiphenyl sulfone |
| Authors of publication | Zhuang, Wenjuan; Sun, Haoling; Xu, Hongbin; Wang, Zheming; Gao, Song; Jin, Linpei |
| Journal of publication | Chemical Communications |
| Year of publication | 2010 |
| Journal volume | 46 |
| Journal issue | 24 |
| Pages of publication | 4339 - 4341 |
| a | 28.219 ± 0.003 Å |
| b | 6.388 ± 0.0007 Å |
| c | 24.928 ± 0.003 Å |
| α | 90° |
| β | 115.2 ± 0.002° |
| γ | 90° |
| Cell volume | 4065.9 ± 0.8 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 13 |
| Hermann-Mauguin space group symbol | P 1 2/c 1 |
| Hall space group symbol | -P 2yc |
| Residual factor for all reflections | 0.0991 |
| Residual factor for significantly intense reflections | 0.047 |
| Weighted residual factors for significantly intense reflections | 0.1087 |
| Weighted residual factors for all reflections included in the refinement | 0.1321 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.032 |
| 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. |
7111614.cif |
| 176453 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7. |
7111614.cif |
| 96700 | 2014-01-29 | cif/ Adding structures of 7111614 via cif-deposit CGI script. |
7111614.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.