Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4303999
Preview
| Coordinates | 4303999.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H8 Co2 S24 |
|---|---|
| Calculated formula | C24 H8 Co2 S24 |
| SMILES | C12=C(S[Co]34(S1)[S](C1=C(S4)SC(=C4SC=CS4)S1)[Co]14([S]3C3=C(S1)SC(=C1SC=CS1)S3)SC1=C(S4)SC(S1)=C1SC=CS1)SC(S2)=C1SC=CS1 |
| Title of publication | Conducting Dimerized Cobalt Complexes with Tetrathiafulvalene Dithiolate Ligands |
| Authors of publication | Emiko Fujiwara; Kazumasa Hosoya; Akiko Kobayashi; Hisashi Tanaka; Madoka Tokumoto; Yoshinori Okano; Hideki Fujiwara; Hayao Kobayashi; Yuichi Fujishiro; Eiji Nishibori; Masaki Takata; Makoto Sakata |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2008 |
| Journal volume | 47 |
| Pages of publication | 863 - 874 |
| a | 11.7164 ± 0.0002 Å |
| b | 10.9496 ± 0.0001 Å |
| c | 7.7319 ± 0.0007 Å |
| α | 79.731 ± 0.001° |
| β | 96.481 ± 0.002° |
| γ | 113.969 ± 0.0009° |
| Cell volume | 890.96 ± 0.08 Å3 |
| Cell temperature | 300 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179077 (current) | 2016-03-22 | cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/39. |
4303999.cif |
| 120081 | 2014-07-12 | Adding DOIs to range 4/30 structures. | 4303999.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4303999.cif |
| 5312 | 2011-01-03 | cif/ Adding files, updated with the 'cif_fix_enum' program and the cif_core.dic dictionary. The enumerator values were fixed, mostly incorrect case, but also some values that had extra underscores, dashes or spaces. Unfortunately, 22 had non-ASCII characters with the 8-th bit set, and these got incorrectly interpreted as latin1 characters and converted to their UTF8 equivalents by Perl. To fix the structures, however, they need to be redeposited from the original files with the new CIFParser/cif_filter version. |
4303999.cif |
| 1163 | 2010-05-11 | cif/4/: committing data from the Inorg-Chem-2008_01-12/ deposition. | 4303999.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.