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Information card for entry 7015888
Preview
| Coordinates | 7015888.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C44 H46 N18 Pt2 S4 |
|---|---|
| Calculated formula | C44 H46 N18 Pt2 S4 |
| SMILES | [Pt]123SC(=N[N]2=C(c2n3nc(n2)C(=NNC(=[S][Pt]23SC(=N[N]2=C(c2n3nc(n2)C(=NNC(=[S]1)Nc1ccc(cc1)C)C)C)Nc1ccc(cc1)C)Nc1ccc(cc1)C)C)C)Nc1ccc(cc1)C |
| Title of publication | Novel bis(thiosemicarbazones) of the 3,5-diacetyl-1,2,4-triazol series and their platinum(ii) complexes: chemistry, antiproliferative activity and preliminary nephrotoxicity studies. |
| Authors of publication | Matesanz, Ana I.; Hernández, Carolina; Rodríguez, Ana; Souza, Pilar |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 21 |
| Pages of publication | 5738 - 5745 |
| a | 14.654 ± 0.004 Å |
| b | 16.423 ± 0.008 Å |
| c | 17.538 ± 0.008 Å |
| α | 117.584 ± 0.011° |
| β | 97.032 ± 0.017° |
| γ | 105.311 ± 0.018° |
| Cell volume | 3457 ± 3 Å3 |
| Cell temperature | 230 ± 2 K |
| Ambient diffraction temperature | 230 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0775 |
| Residual factor for significantly intense reflections | 0.0518 |
| Weighted residual factors for significantly intense reflections | 0.1398 |
| Weighted residual factors for all reflections included in the refinement | 0.1508 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.968 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179862 (current) | 2016-03-25 | cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/58. |
7015888.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015888.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015888.cif |
| 21374 | 2011-06-22 | ../uploads/cif-deposit/cod/cif Adding structures of 7015888 via cif-deposit CGI script. |
7015888.cif |
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Users of the data should acknowledge the original authors of the
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