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Information card for entry 7121716
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Coordinates | 7121716.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | GR1JM537C |
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Formula | C35 H33 Cl3 |
Calculated formula | C35 H33 Cl3 |
Title of publication | Palladium-catalyzed cocyclotrimerization of arynes with a pyramidalized alkene. |
Authors of publication | Alonso, José M; Quiroga, Sabela; Codony, Sandra; Turcu, Andreea L.; Barniol-Xicota, Marta; Pérez, Dolores; Guitián, Enrique; Vázquez, Santiago; Peña, Diego |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 47 |
Pages of publication | 5996 - 5999 |
a | 9.5957 ± 0.0002 Å |
b | 12.2865 ± 0.0003 Å |
c | 13.243 ± 0.0003 Å |
α | 73.4435 ± 0.0014° |
β | 72.2898 ± 0.0011° |
γ | 73.1598 ± 0.0011° |
Cell volume | 1389.97 ± 0.06 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0743 |
Residual factor for significantly intense reflections | 0.0472 |
Weighted residual factors for significantly intense reflections | 0.1146 |
Weighted residual factors for all reflections included in the refinement | 0.1279 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
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.
The link is: https://www.crystallography.net/7121716.html
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Users of the data should acknowledge the original authors of the
structural data.