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Information card for entry 7156652
Preview
Coordinates | 7156652.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H11 F N2 O |
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Calculated formula | C16 H11 F N2 O |
Title of publication | Copper-mediated oxidative [3 + 2]-annulation of nitroalkenes and pyridinium ylides: general access to functionalized indolizines and efficient synthesis of 1-fluoroindolizines. |
Authors of publication | Motornov, Vladimir A.; Tabolin, Andrey A.; Nelyubina, Yulia V.; Nenajdenko, Valentine G.; Ioffe, Sema L. |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2019 |
Journal volume | 17 |
Journal issue | 6 |
Pages of publication | 1442 - 1454 |
a | 8.3168 ± 0.0009 Å |
b | 9.3791 ± 0.0012 Å |
c | 18.018 ± 0.002 Å |
α | 92.69 ± 0.003° |
β | 99.941 ± 0.003° |
γ | 114.17 ± 0.003° |
Cell volume | 1252.1 ± 0.3 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 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 | 0.0951 |
Residual factor for significantly intense reflections | 0.0576 |
Weighted residual factors for significantly intense reflections | 0.124 |
Weighted residual factors for all reflections included in the refinement | 0.1484 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
225148 (current) | 2019-11-08 | cif/ Updating files of 7156652 Original log message: Adding full bibliography for 7156652.cif. |
7156652.cif |
213180 | 2019-01-17 | cif/ Adding structures of 7156652 via cif-deposit CGI script. |
7156652.cif |
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Users of the data should acknowledge the original authors of the
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