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Information card for entry 7045666
Preview
| Coordinates | 7045666.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C78 H98 N17 O26 P5 Pt15 |
|---|---|
| Calculated formula | C78 H98 N17 O26 P5 Pt15 |
| SMILES | [Pt]123([Pt]4([Pt]1(C4=O)(C#[O])C2=O)(C3=O)C#[O])[P]12CN3CN(C1)CN(C2)C3.[Pt]123([Pt]4([Pt]1(C2=O)(C#[O])C4=O)(C#[O])C3=O)[P]12CN3CN(C1)CN(C2)C3.[Pt]123([Pt]4([Pt]1(C4=O)(C#[O])C3=O)(C2=O)C#[O])[P]12CN3CN(C1)CN(C2)C3.[Pt]123([Pt]4([Pt]1(C4=O)(C3=O)[P]13CN4CN(C1)CN(C3)C4)(C#[O])C2=O)C#[O].[Pt]123([Pt]4(C2=O)(C#[O])C([Pt]14(C#[O])C3=O)=O)[P]12CN3CN(C1)CN(C2)C3.[N+](C)(C)(C)Cc1ccccc1.[N+](C)(C)(C)Cc1ccccc1.O=C(C)C |
| Title of publication | Water soluble derivatives of platinum carbonyl Chini clusters: synthesis, molecular structures and cytotoxicity of [Pt<sub>12</sub>(CO)<sub>20</sub>(PTA)<sub>4</sub>]<sup>2-</sup> and [Pt<sub>15</sub>(CO)<sub>25</sub>(PTA)<sub>5</sub>]<sup>2-</sup> . |
| Authors of publication | Batchelor, Lucinda K.; Berti, Beatrice; Cesari, Cristiana; Ciabatti, Iacopo; Dyson, Paul J.; Femoni, Cristina; Iapalucci, Maria C.; Mor, Matteo; Ruggieri, Silvia; Zacchini, Stefano |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2018 |
| Journal volume | 47 |
| Journal issue | 13 |
| Pages of publication | 4467 - 4477 |
| a | 13.263 ± 0.0007 Å |
| b | 26.2687 ± 0.0014 Å |
| c | 30.2864 ± 0.0016 Å |
| α | 90° |
| β | 94.781 ± 0.001° |
| γ | 90° |
| Cell volume | 10515.1 ± 1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.1563 |
| Residual factor for significantly intense reflections | 0.1103 |
| Weighted residual factors for significantly intense reflections | 0.2163 |
| Weighted residual factors for all reflections included in the refinement | 0.2365 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.151 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 229741 (current) | 2019-11-17 | cif/ Updating files of 7045665, 7045666 Original log message: Adding full bibliography for 7045665--7045666.cif. |
7045666.cif |
| 206477 | 2018-02-17 | cif/ Adding structures of 7045665, 7045666 via cif-deposit CGI script. |
7045666.cif |
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Users of the data should acknowledge the original authors of the
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