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Information card for entry 1518629
Preview
| Coordinates | 1518629.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Chlorido-(N,N-dimethyl(4-methoxy)benzylamine- κN,κC)-tris(4-trifluoromethylphenyl)phosphane-platinum(II) |
|---|---|
| Formula | C31 H26 Cl F9 N O P Pt |
| Calculated formula | C31 H26 Cl F9 N O P Pt |
| SMILES | [Pt]1(Cl)([P](c2ccc(cc2)C(F)(F)F)(c2ccc(cc2)C(F)(F)F)c2ccc(cc2)C(F)(F)F)[N](C)(C)Cc2c1cc(OC)cc2 |
| Title of publication | Dual Antitumor and Antiangiogenic Activity of Organoplatinum(II) Complexes. |
| Authors of publication | Zamora, Ana; Pérez, Sergio A; Rodríguez, Venancio; Janiak, Christoph; Yellol, Gorakh S.; Ruiz, José |
| Journal of publication | Journal of medicinal chemistry |
| Year of publication | 2015 |
| Journal volume | 58 |
| Journal issue | 3 |
| Pages of publication | 1320 - 1336 |
| a | 17.3951 ± 0.0008 Å |
| b | 14.9557 ± 0.0007 Å |
| c | 11.9109 ± 0.0005 Å |
| α | 90° |
| β | 98.576 ± 0.002° |
| γ | 90° |
| Cell volume | 3064 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 8 |
| 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 | 0.0206 |
| Residual factor for significantly intense reflections | 0.0185 |
| Weighted residual factors for significantly intense reflections | 0.0409 |
| Weighted residual factors for all reflections included in the refinement | 0.0418 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1518629.cif |
| 132910 | 2015-03-04 | cif/ Updating files of 1518628, 1518629 Original log message: Adding full bibliography for 1518628--1518629.cif. |
1518629.cif |
| 130673 | 2015-02-04 | cif/ Adding structures of 1518629 via cif-deposit CGI script. |
1518629.cif |
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