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Information card for entry 4337104
Preview
| Coordinates | 4337104.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Chemical name | bis(Phenylethynyl)-(1,1'-dipentyl-3,3'-methylene-bis(benzimidazoline) -2,2'-diylidene)-platinum(II) dichloromethane pentane solvate 4/1/1 |
|---|---|
| Formula | C85 H91 Cl N8 Pt2 |
| Calculated formula | C85 H91 Cl N8 Pt2 |
| Title of publication | Tuning the Luminescent Properties of Pt(II) Acetylide Complexes through Varying the Electronic Properties of N-Heterocyclic Carbene Ligands. |
| Authors of publication | Zhang, Yuzhen; Clavadetscher, Jessica; Bachmann, Michael; Blacque, Olivier; Venkatesan, Koushik |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 2 |
| Pages of publication | 756 - 771 |
| a | 16.9885 ± 0.0007 Å |
| b | 25.65 ± 0.0008 Å |
| c | 19.5345 ± 0.0009 Å |
| α | 90° |
| β | 114.494 ± 0.005° |
| γ | 90° |
| Cell volume | 7746.2 ± 0.6 Å3 |
| Cell temperature | 183 ± 2 K |
| Ambient diffraction temperature | 183 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.1091 |
| Residual factor for significantly intense reflections | 0.0701 |
| Weighted residual factors for significantly intense reflections | 0.1433 |
| Weighted residual factors for all reflections included in the refinement | 0.1629 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301839 (current) | 2025-08-21 | Add cross-references to PubChem compounds in COD range 4/33/ Each referenced PubChem compound corresponds to the full crystal structure. |
4337104.cif |
| 179474 | 2016-03-23 | cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/71. |
4337104.cif |
| 106159 | 2014-03-15 | cif/ Adding structures of 4337102, 4337103, 4337104, 4337105 via cif-deposit CGI script. |
4337104.cif |
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Users of the data should acknowledge the original authors of the
structural data.