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Information card for entry 7129231
Preview
| Coordinates | 7129231.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C6 H18 Cl4 N2 Pd |
|---|---|
| Calculated formula | C6 H18 Cl4 N2 Pd |
| Title of publication | Experimental and Theoretical Evidence of Attractive Interactions between Dianions: [PdCl4]2- ···[PdCl4]2- |
| Authors of publication | Zierkiewicz, Wiktor; Michalczyk, Mariusz; Maris, Thierry; Wysokinski, Rafal; Scheiner, Steve |
| Journal of publication | Chemical Communications |
| Year of publication | 2021 |
| a | 7.2281 ± 0.0007 Å |
| b | 8.1281 ± 0.0005 Å |
| c | 11.7212 ± 0.0012 Å |
| α | 70.892 ± 0.004° |
| β | 87.545 ± 0.005° |
| γ | 89.101 ± 0.003° |
| Cell volume | 650.09 ± 0.1 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 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 | 0.041 |
| Residual factor for significantly intense reflections | 0.037 |
| Weighted residual factors for significantly intense reflections | 0.0882 |
| Weighted residual factors for all reflections included in the refinement | 0.0894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.146 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Duplicate of | 1559914 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287519 (current) | 2023-11-10 | cod/ (saulius@tasmanijos-velnias) Marking up COD duplicates based on automatic matching in: Path: outputs/cod-new-duplicates-expanded.tsv Name: cod-new-duplicates-expanded.tsv Working Copy Root Path: /home/saulius/struct/COD-crude-data URL: svn+ssh://www.crystallography.net/home/coder/svn-repositories/COD-crude-data/archives/2021/COD/outputs/cod-new-duplicates-expanded.tsv Relative URL: ^/archives/2021/COD/outputs/cod-new-duplicates-expanded.tsv Repository Root: svn+ssh://www.crystallography.net/home/coder/svn-repositories/COD-crude-data Repository UUID: f03e6fd5-de02-4a89-aa47-d94ad8425ebd Revision: 7431 Node Kind: file Schedule: normal Last Changed Author: saulius Last Changed Rev: 7431 Last Changed Date: 2023-11-10 16:55:42 +0200 (Fri, 10 Nov 2023) Text Last Updated: 2023-11-10 16:31:20 +0200 (Fri, 10 Nov 2023) Checksum: 0c965281867bf38581b3e32df20963a23950bd46 |
7129231.cif |
| 270660 | 2021-11-16 | cif/ Adding structures of 7129231 via cif-deposit CGI script. |
7129231.cif |
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Users of the data should acknowledge the original authors of the
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