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Information card for entry 7224633
Preview
Coordinates | 7224633.cif |
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Original paper (by DOI) | HTML |
Common name | 4-(4-Trifluoromethylphenyl)-1,2,3,5-dithiadiazolyl triphenylstibine 2:1 |
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Chemical name | 2,7-bis[4-(trifluoromethyl)phenyl]-4/l4,5/l4,9/l4,10/l4-tetrathieto[1,2-a:3,4-a']bis[1,2,3,5]dithiadiazole triphenylstibine |
Formula | C34 H23 F6 N4 S4 Sb |
Calculated formula | C34 H23 F6 N4 S4 Sb |
Title of publication | Short contacts of the sulphur atoms of a 1,2,3,5-dithiadiazolyl dimer with triphenylstibine: first co-crystal with an aromatic compound |
Authors of publication | Boeré, René T. |
Journal of publication | CrystEngComm |
Year of publication | 2016 |
Journal volume | 18 |
Journal issue | 15 |
Pages of publication | 2748 |
a | 11.4543 ± 0.001 Å |
b | 11.7399 ± 0.001 Å |
c | 13.948 ± 0.0012 Å |
α | 73.364 ± 0.001° |
β | 73.247 ± 0.001° |
γ | 82.579 ± 0.001° |
Cell volume | 1718.6 ± 0.3 Å3 |
Cell temperature | 263 ± 2 K |
Ambient diffraction temperature | 263 ± 2 K |
Ambient diffracton pressure | 101 kPa |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0404 |
Residual factor for significantly intense reflections | 0.0313 |
Weighted residual factors for significantly intense reflections | 0.0789 |
Weighted residual factors for all reflections included in the refinement | 0.0864 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
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