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Information card for entry 4071813
Preview
| Coordinates | 4071813.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C32 H38 N4 Pt S |
|---|---|
| Calculated formula | C32 H38 N4 Pt S |
| SMILES | [Pt]1([S](C)C)([N](=C(c2n1nc(c2C)C(=N\c1c(cccc1C)C)\C)C)c1c(cccc1C)C)c1ccccc1 |
| Title of publication | Mononuclear Organometallic Platinum(II) Complexes and Platinum(II)−Copper(I) Mixed Complexes from Symmetrical 3,5-Bis(iminoacetyl)pyrazolate Ligands |
| Authors of publication | Moret, Marc-Etienne; Chen, Peter |
| Journal of publication | Organometallics |
| Year of publication | 2008 |
| Journal volume | 27 |
| Journal issue | 19 |
| Pages of publication | 4903 |
| a | 7.8393 ± 0.0014 Å |
| b | 13.7453 ± 0.0017 Å |
| c | 14.55 ± 0.0017 Å |
| α | 94.905 ± 0.012° |
| β | 97.696 ± 0.012° |
| γ | 97.36 ± 0.013° |
| Cell volume | 1532.5 ± 0.4 Å3 |
| Cell temperature | 220 ± 2 K |
| Ambient diffraction temperature | 220 ± 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 | 0.0599 |
| Residual factor for significantly intense reflections | 0.0501 |
| Weighted residual factors for significantly intense reflections | 0.1182 |
| Weighted residual factors for all reflections included in the refinement | 0.1244 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.095 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178607 (current) | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/18. |
4071813.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4071813.cif |
| 47256 | 2012-03-23 | cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories. |
4071813.cif |
| 44059 | 2012-03-15 | ../uploads/cif-deposit/cod/cif Adding structures of 4071812, 4071813, 4071814, 4071815, 4071816, 4071817, 4071818 via cif-deposit CGI script. |
4071813.cif |
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Users of the data should acknowledge the original authors of the
structural data.