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Information card for entry 7029512
Preview
| Coordinates | 7029512.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H8 Bi2 Co2 N4 Na4 O107 W20 |
|---|---|
| Calculated formula | C6 H8 Bi2 Co2 N4 Na4 O107 W20 |
| SMILES | c1ncc[nH]1.O.O.O.[Na+].O.[Na+].O.O.O.O.O.O=[W]1234O[W]5678O[W]9%10(=O)(=O)O[W]%11%12%13%14O[W](=O)(=O)(O6)(O[W]6%15%16(O[W]%17%18%19(=O)O[W]%20%21(=O)(=[O][Co]([OH2])([OH2])([OH2])([O]=%18)[O]=%11)O[W]%11%18(=O)(O[W]%22(O%17)(=O)(O%15)[O]%16%19[Bi]([O]37[W](O6)(=O)(O2)(O%22)O8)[O]%21%18[W](=O)(O%20)(O%10)(O4)O%11)O1)=O)O[W]123(=O)O[W]467(=O)=[O][Co]([OH2])([OH2])([OH2])([O]=5)[O]=[W]58(=O)(O[W]%10%11(=O)(O[W]%15%16(=O)(O[W]%17(=O)(O[W]%18(=O)(O[W](O5)(=O)(O%10)([O]8%11[Bi]([O]%13%15%17)[O]37%18)O%16)(O6)O2)(O%12)O1)O%14)O9)O4.O.O.O.O.O.O.O.O.O.O.O.c1ncc[nH]1.O.O.O.O.[Na+].O.[Na+].O.O.O.O.O.O |
| Title of publication | The inhibitory effects of a new cobalt-based polyoxometalate on the growth of human cancer cells. |
| Authors of publication | Wang, Lu; Yu, Kai; Zhou, Bai-Bin; Su, Zhan-Hua; Gao, Song; Chu, Li-Li; Liu, Jia-Ren |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2014 |
| Journal volume | 43 |
| Journal issue | 16 |
| Pages of publication | 6070 - 6078 |
| a | 12.4832 ± 0.0005 Å |
| b | 13.6886 ± 0.0005 Å |
| c | 16.9954 ± 0.0006 Å |
| α | 69.468 ± 0.001° |
| β | 83.067 ± 0.001° |
| γ | 64.684 ± 0.001° |
| Cell volume | 2456.99 ± 0.16 Å3 |
| Cell temperature | 273 ± 2 K |
| Ambient diffraction temperature | 273 ± 2 K |
| Number of distinct elements | 8 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.064 |
| Residual factor for significantly intense reflections | 0.0533 |
| Weighted residual factors for significantly intense reflections | 0.143 |
| Weighted residual factors for all reflections included in the refinement | 0.1512 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation wavelength | 0.71073 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. |
7029512.cif |
| 108332 | 2014-03-30 | cif/ Adding structures of 7029512 via cif-deposit CGI script. |
7029512.cif |
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Users of the data should acknowledge the original authors of the
structural data.