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Information card for entry 7041122
Preview
| Coordinates | 7041122.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H52 Cl F6 N6 O4 P Ru2 S2 |
|---|---|
| Calculated formula | C38 H52 Cl F6 N6 O4 P Ru2 S2 |
| SMILES | [Ru]1234567([S](C(N)=[N]2N=Cc2cc(OC)ccc2)[Ru]289%10%11%12([S]1C(N)=[N]2N=Cc1cc(OC)ccc1)[c]1([cH]%12[cH]%11[c]%10([cH]9[cH]81)C(C)C)C)[c]1([cH]3[cH]4[c]5([cH]6[cH]71)C(C)C)C.[Cl-].[P](F)(F)(F)(F)(F)[F-].O.O |
| Title of publication | New dinuclear ruthenium arene complexes containing thiosemicarbazone ligands: synthesis, structure and cytotoxic studies. |
| Authors of publication | Su, Wei; Tang, Zhaofeng; Li, Peiyuan; Wang, Gufeng; Xiao, Qi; Li, Yuchun; Huang, Shan; Gu, Yunqiong; Lai, Zefeng; Zhang, Yuexing |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 48 |
| Pages of publication | 19329 - 19340 |
| a | 12.8583 ± 0.0011 Å |
| b | 15.1999 ± 0.0011 Å |
| c | 24.0255 ± 0.0013 Å |
| α | 90° |
| β | 95.636 ± 0.006° |
| γ | 90° |
| Cell volume | 4673 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 9 |
| 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 | 0.1812 |
| Residual factor for significantly intense reflections | 0.0919 |
| Weighted residual factors for significantly intense reflections | 0.1517 |
| Weighted residual factors for all reflections included in the refinement | 0.1844 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.096 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 190125 (current) | 2017-01-09 | cif/ Updating files of 7041117, 7041118, 7041119, 7041120, 7041121, 7041122, 7041123, 7041124, 7041125, 7041126 Original log message: Adding full bibliography for 7041117--7041126.cif. |
7041122.cif |
| 188027 | 2016-11-08 | cif/ Adding structures of 7041117, 7041118, 7041119, 7041120, 7041121, 7041122, 7041123, 7041124, 7041125, 7041126 via cif-deposit CGI script. |
7041122.cif |
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Users of the data should acknowledge the original authors of the
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