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Information card for entry 4064188
Preview
| Coordinates | 4064188.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | ad358-1 |
|---|---|
| Formula | C68.6 H60.6 Cl6.8 N4 O1.5 Pt4 |
| Calculated formula | C64 H50 Cl2 N4 Pt4 |
| SMILES | c1ccc2ccc3cccc4c3c2[n]1[Pt]124[C](#[C]1C(C)(C)C)[Pt]1(c3cccc4ccc5ccc[n]1c5c34)[Cl][Pt]1(c3cccc4ccc5ccc[n]1c5c34)[C]1#[C](C(C)(C)C)[Pt]31(c1cccc4ccc5ccc[n]3c5c14)[Cl]2 |
| Title of publication | Remarkable Influence of the Cyclometalating Ligand on the Nuclearity and Properties of Heterobridged (μ-X)(μ-C≡CR) Platinum(II) Complexes |
| Authors of publication | Berenguer, Jesús R.; Díez, Álvaro; García, Ana; Lalinde, Elena; Moreno, M. Teresa; Sánchez, Sergio; Torroba, Javier |
| Journal of publication | Organometallics |
| Year of publication | 2011 |
| Journal volume | 30 |
| Journal issue | 6 |
| Pages of publication | 1646 |
| a | 48.7851 ± 0.001 Å |
| b | 17.6611 ± 0.0003 Å |
| c | 36.0601 ± 0.0007 Å |
| α | 90° |
| β | 126.509 ± 0.001° |
| γ | 90° |
| Cell volume | 24972.4 ± 0.9 Å3 |
| Cell temperature | 173 ± 1 K |
| Ambient diffraction temperature | 173 ± 1 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.069 |
| Residual factor for significantly intense reflections | 0.0441 |
| Weighted residual factors for significantly intense reflections | 0.1022 |
| Weighted residual factors for all reflections included in the refinement | 0.1098 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176467 (current) | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4064188.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4064188.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4064188.cif |
| 32810 | 2012-02-10 | ../uploads/cif-deposit/cod/cif Adding structures of 4064187, 4064188, 4064189 via cif-deposit CGI script. |
4064188.cif |
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