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Information card for entry 7056195
Preview
Coordinates | 7056195.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H48 F4 O10 S4 Sn4 |
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Calculated formula | C40 H48 F4 O10 S4 Sn4 |
SMILES | c1cc(ccc1SCC(=O)O[Sn]1(C)([O]2[Sn]3(C)([O]([Sn]2(OC(=[O]1)CSc1ccc(F)cc1)(C)C)[Sn](C)(OC(=O)CSc1ccc(cc1)F)([O]=C(O3)CSc1ccc(F)cc1)C)C)C)F |
Title of publication | Novel organotin(IV) Complexes derived from 4-fluorophenyl- selenoacetic acid: synthesis, characterization and in vitro cytostatic activity evaluation |
Authors of publication | Qiu, Ya-Ru; Zhang, Ru-Fen; Zhang, Shaoliang; Cheng, Shuang; Li, Qianli; Ma, Chunlin |
Journal of publication | New J. Chem. |
Year of publication | 2017 |
a | 11.6817 ± 0.0009 Å |
b | 11.9698 ± 0.001 Å |
c | 17.8333 ± 0.0015 Å |
α | 90° |
β | 94.401 ± 0.001° |
γ | 90° |
Cell volume | 2486.2 ± 0.4 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0874 |
Residual factor for significantly intense reflections | 0.0437 |
Weighted residual factors for significantly intense reflections | 0.0779 |
Weighted residual factors for all reflections included in the refinement | 0.093 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.962 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7056195.html
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Users of the data should acknowledge the original authors of the
structural data.