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Information card for entry 7157540
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Coordinates | 7157540.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H24 Cl3 N3 O6 |
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Calculated formula | C30 H24 Cl3 N3 O6 |
Title of publication | Light-induced one-pot synthesis of pyrimidine derivatives from vinyl azides. |
Authors of publication | Nguyen, Tuan K.; Titov, Gleb D.; Khoroshilova, Olesya V.; Kinzhalov, Mikhail A.; Rostovskii, Nikolai V. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2020 |
Journal volume | 18 |
Journal issue | 26 |
Pages of publication | 4971 - 4982 |
a | 10.9534 ± 0.0008 Å |
b | 12.5947 ± 0.0013 Å |
c | 13.2276 ± 0.001 Å |
α | 100.624 ± 0.008° |
β | 113.849 ± 0.007° |
γ | 110.012 ± 0.008° |
Cell volume | 1453.4 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.078 |
Residual factor for significantly intense reflections | 0.063 |
Weighted residual factors for significantly intense reflections | 0.1702 |
Weighted residual factors for all reflections included in the refinement | 0.1833 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
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/7157540.html
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Users of the data should acknowledge the original authors of the
structural data.