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Information card for entry 4065645
Preview
| Coordinates | 4065645.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | 4.3.5CHCl3 |
|---|---|
| Formula | C61.5 H43.5 Au2 Cl10.5 P2 |
| Calculated formula | C61.5 H43.5 Au2 Cl10.5 P2 |
| Title of publication | Gold(I) and Platinum(II) Tetracenes and Tetracenyldiacetylides: Structural and Fluorescence Color Changes Induced by σ-Metalation |
| Authors of publication | Nguyen, Minh-Hai; Yip, John H. K. |
| Journal of publication | Organometallics |
| Year of publication | 2010 |
| Journal volume | 29 |
| Journal issue | 11 |
| Pages of publication | 2422 |
| a | 13.1311 ± 0.0017 Å |
| b | 14.635 ± 0.002 Å |
| c | 16.498 ± 0.002 Å |
| α | 89.38 ± 0.003° |
| β | 86.435 ± 0.003° |
| γ | 70.71 ± 0.003° |
| Cell volume | 2986.5 ± 0.7 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 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 | 0.1096 |
| Residual factor for significantly intense reflections | 0.0696 |
| Weighted residual factors for significantly intense reflections | 0.1575 |
| Weighted residual factors for all reflections included in the refinement | 0.1794 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.007 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301829 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/06/ Each referenced PubChem compound corresponds to the full crystal structure. |
4065645.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4065645.cif |
| 91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4065645.cif |
| 34330 | 2012-02-24 | cif/4/ Reorganising CIF range 4 into a prefix tree. |
4065645.cif |
| 33640 | 2012-02-13 | ../uploads/cif-deposit/cod/cif Adding structures of 4065645 via cif-deposit CGI script. |
4065645.cif |
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Users of the data should acknowledge the original authors of the
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