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Information card for entry 7248225
Preview
Coordinates | 7248225.cif |
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Original paper (by DOI) | HTML |
Chemical name | 4,4',4'',4'''-(([2,2'-bi(1,3-dithiolylidene)]-4,4',5,5'-tetrayltetrakis(sulfanediyl))tetrakis(methylene))tetrabenzoic acid, dimethylsufoxide solvate |
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Formula | C42 H40 O10 S10 |
Calculated formula | C42 H40 O10 S10 |
Title of publication | Metal–organic polyhedron from a flexible tetrakis(thiobenzyl-carboxylate)-tetrathiafulvalene |
Authors of publication | Cheret, Yohan; Avarvari, Narcis; Zigon, Nicolas |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 15 |
Pages of publication | 2072 - 2077 |
a | 21.798 ± 0.0012 Å |
b | 6.3399 ± 0.0005 Å |
c | 16.8128 ± 0.001 Å |
α | 90° |
β | 90.723 ± 0.006° |
γ | 90° |
Cell volume | 2323.3 ± 0.3 Å3 |
Cell temperature | 250 ± 0.1 K |
Ambient diffraction temperature | 250 ± 0.1 K |
Number of distinct elements | 4 |
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 | 0.079 |
Residual factor for significantly intense reflections | 0.0582 |
Weighted residual factors for significantly intense reflections | 0.155 |
Weighted residual factors for all reflections included in the refinement | 0.1759 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7248225.html
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