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Information card for entry 7238879
Preview
Coordinates | 7238879.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H20 F3 N3 O |
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Calculated formula | C28 H20 F3 N3 O |
Title of publication | l-Proline-catalyzed three-component domino reactions in the regioselective synthesis of novel densely functionalized pyrazolo[3,4-b]pyridines |
Authors of publication | Gunasekaran, Pethaiah; Indumathi, Sethuraman; Perumal, Subbu |
Journal of publication | RSC Advances |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 22 |
Pages of publication | 8318 |
a | 16.8695 ± 0.0014 Å |
b | 10.4525 ± 0.0008 Å |
c | 27.352 ± 0.003 Å |
α | 90° |
β | 103.47 ± 0.005° |
γ | 90° |
Cell volume | 4690.3 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0974 |
Residual factor for significantly intense reflections | 0.0487 |
Weighted residual factors for significantly intense reflections | 0.1193 |
Weighted residual factors for all reflections included in the refinement | 0.1432 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
244441 (current) | 2019-11-28 | cif/ Adding structures of 7238879 via cif-deposit CGI script. |
7238879.cif |
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Users of the data should acknowledge the original authors of the
structural data.