Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7030063
Preview
| Coordinates | 7030063.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C108 H94 O13 Sb4 |
|---|---|
| Calculated formula | C108 H94 O13 Sb4 |
| SMILES | [Sb]12(c3ccccc3)(c3ccccc3)(c3ccccc3)O[C@H](C(=[O]1)O[Sb]1(c3ccccc3)(c3ccccc3)(c3ccccc3)O[C@@H](C(=[O][Sb]3(c4ccccc4)(c4ccccc4)(c4ccccc4)O[C@H](C(=[O]3)O[Sb]3(c4ccccc4)(c4ccccc4)(c4ccccc4)O[C@@H](C(=[O]3)O2)c2ccccc2)c2ccccc2)O1)c1ccccc1)c1ccccc1.CCOCC |
| Title of publication | Novel tetranuclear triarylantimony(V) complexes with (±)-mandelic acid ligands: synthesis, characterization, in vitro cytotoxicity and DNA binding properties. |
| Authors of publication | Jiang, Jin; Yin, Handong; Wang, Fangli; Han, Zhong; Wang, Fei; Cheng, Shuang; Hong, Min |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2013 |
| Journal volume | 42 |
| Journal issue | 24 |
| Pages of publication | 8563 - 8566 |
| a | 14.044 ± 0.0013 Å |
| b | 42.816 ± 0.003 Å |
| c | 17.341 ± 0.0016 Å |
| α | 90° |
| β | 114.915 ± 0.002° |
| γ | 90° |
| Cell volume | 9456.9 ± 1.4 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.1053 |
| Residual factor for significantly intense reflections | 0.0693 |
| Weighted residual factors for significantly intense reflections | 0.1335 |
| Weighted residual factors for all reflections included in the refinement | 0.1497 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.128 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180006 (current) | 2016-03-25 | cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/00. |
7030063.cif |
| 111377 | 2014-04-22 | cif/ Adding structures of 7030063, 7030064, 7030065, 7030066, 7030067, 7030068, 7030069 via cif-deposit CGI script. |
7030063.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.