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Information card for entry 4038528
Preview
Coordinates | 4038528.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H10 Co2 O9 |
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Calculated formula | C22 H10 Co2 O9 |
Title of publication | Intramolecular Nicholas Reactions in the Synthesis of Heteroenediynes fused to Indole, Triazole and Isocoumarin. |
Authors of publication | Danilkina, Natalia A.; D'yachenko, Alexander; Govdi, Anastasia I.; Khlebnikov, Alexander F.; Kornyakov, Ilya; Bräse, Stefan; Balova, Irina A. |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2020 |
a | 13.17979 ± 0.00014 Å |
b | 13.5664 ± 0.00015 Å |
c | 13.59048 ± 0.00012 Å |
α | 105.804 ± 0.0009° |
β | 105.681 ± 0.0009° |
γ | 105.509 ± 0.001° |
Cell volume | 2093.08 ± 0.05 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0428 |
Residual factor for significantly intense reflections | 0.0382 |
Weighted residual factors for significantly intense reflections | 0.1058 |
Weighted residual factors for all reflections included in the refinement | 0.1082 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.088 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4038528.html
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Users of the data should acknowledge the original authors of the
structural data.