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Information card for entry 7238889
Preview
| Coordinates | 7238889.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H30 Br2 N4 O2 |
|---|---|
| Calculated formula | C38 H30 Br2 N4 O2 |
| Title of publication | Interplay of monomer, intra- and intermolecular excimer fluorescence in cyclophanes and selective recognition of methanol vapours |
| Authors of publication | Nandajan, Paramjyothi C.; Neelakandan, Prakash P.; Ramaiah, Danaboyina |
| Journal of publication | RSC Advances |
| Year of publication | 2013 |
| Journal volume | 3 |
| Journal issue | 16 |
| Pages of publication | 5624 |
| a | 8.3588 ± 0.0002 Å |
| b | 10.3505 ± 0.0003 Å |
| c | 10.9632 ± 0.0003 Å |
| α | 63.8699 ± 0.0015° |
| β | 84.6098 ± 0.0015° |
| γ | 83.0969 ± 0.0016° |
| Cell volume | 844.5 ± 0.04 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 | 0.0844 |
| Residual factor for significantly intense reflections | 0.0786 |
| Weighted residual factors for significantly intense reflections | 0.2179 |
| Weighted residual factors for all reflections included in the refinement | 0.2278 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244448 (current) | 2019-11-28 | cif/ Adding structures of 7238889, 7238890 via cif-deposit CGI script. |
7238889.cif |
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Users of the data should acknowledge the original authors of the
structural data.