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Information card for entry 7236215
Preview
| Coordinates | 7236215.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H15 N O2 |
|---|---|
| Calculated formula | C22 H15 N O2 |
| Title of publication | Highly stable naphthalene core based novel cleft-shaped strain molecule: influence of intermolecular H-bonding architectures |
| Authors of publication | Panja, Sumit Kumar; Dwivedi, Nidhi; Saha, Satyen |
| Journal of publication | RSC Advances |
| Year of publication | 2016 |
| Journal volume | 6 |
| Journal issue | 64 |
| Pages of publication | 59574 |
| a | 9.795 ± 0.005 Å |
| b | 22.599 ± 0.005 Å |
| c | 7.252 ± 0.005 Å |
| α | 90 ± 0.005° |
| β | 105.001 ± 0.005° |
| γ | 90 ± 0.005° |
| Cell volume | 1550.6 ± 1.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0654 |
| Residual factor for significantly intense reflections | 0.045 |
| Weighted residual factors for significantly intense reflections | 0.0998 |
| Weighted residual factors for all reflections included in the refinement | 0.1123 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.02 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 235279 (current) | 2019-11-23 | cif/ Adding structures of 7236215 via cif-deposit CGI script. |
7236215.cif |
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Users of the data should acknowledge the original authors of the
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