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Information card for entry 7239050
Preview
| Coordinates | 7239050.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C19 H27 N3 O4 |
|---|---|
| Calculated formula | C19 H27 N3 O4 |
| Title of publication | An exclusive approach to 3,4-disubstituted cyclopentenes and alkylidene cyclopentenes via the palladium catalyzed ring opening of azabicyclic olefins with aryl halides |
| Authors of publication | Joseph, Nayana; Rajan, Rani; John, Jubi; Devika, N. V.; Chand, S. Sarath; Suresh, E.; Pihko, Petri M.; Radhakrishnan, K. V. |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 21 |
| Pages of publication | 7751 |
| a | 9.524 ± 0.003 Å |
| b | 9.968 ± 0.003 Å |
| c | 10.582 ± 0.003 Å |
| α | 96.259 ± 0.005° |
| β | 102.562 ± 0.005° |
| γ | 90.735 ± 0.005° |
| Cell volume | 974 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.0925 |
| Residual factor for significantly intense reflections | 0.0783 |
| Weighted residual factors for significantly intense reflections | 0.1668 |
| Weighted residual factors for all reflections included in the refinement | 0.175 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.182 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301866 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/23/ Each referenced PubChem compound corresponds to the full crystal structure. |
7239050.cif |
| 244522 | 2019-11-28 | cif/ Adding structures of 7239050 via cif-deposit CGI script. |
7239050.cif |
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Users of the data should acknowledge the original authors of the
structural data.