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Information card for entry 7015505
Preview
| Coordinates | 7015505.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H34 Cl2 N6 O2 Pt |
|---|---|
| Calculated formula | C24 H34 Cl2 N6 O2 Pt |
| SMILES | [Pt](Cl)(Cl)([N]1[C@@H](N(OC=1N(C)C)C)c1ccc(cc1)C)[N]1[C@@H](N(OC=1N(C)C)C)c1ccc(cc1)C.[Pt](Cl)(Cl)([N]1[C@H](N(OC=1N(C)C)C)c1ccc(cc1)C)[N]1[C@H](N(OC=1N(C)C)C)c1ccc(cc1)C |
| Title of publication | Unexpectedly efficient activation of push-pull nitriles by a Pt(II) center toward dipolar cycloaddition of Z-nitrones. |
| Authors of publication | Kritchenkov, Andreii S.; Bokach, Nadezhda A.; Haukka, Matti; Kukushkin, Vadim Yu |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2011 |
| Journal volume | 40 |
| Journal issue | 16 |
| Pages of publication | 4175 - 4182 |
| a | 16.0916 ± 0.0004 Å |
| b | 9.3706 ± 0.0002 Å |
| c | 18.3895 ± 0.0003 Å |
| α | 90° |
| β | 91.5729 ± 0.0013° |
| γ | 90° |
| Cell volume | 2771.87 ± 0.1 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/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0505 |
| Residual factor for significantly intense reflections | 0.0283 |
| Weighted residual factors for significantly intense reflections | 0.0534 |
| Weighted residual factors for all reflections included in the refinement | 0.0598 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 179859 (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 7/01/55. |
7015505.cif |
| 120112 | 2014-07-12 | Adding DOIs to range 7 structures. | 7015505.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7015505.cif |
| 21177 | 2011-06-21 | ../uploads/cif-deposit/cod/cif Adding structures of 7015505, 7015506, 7015507, 7015508 via cif-deposit CGI script. |
7015505.cif |
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