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Information card for entry 7228357
Preview
| Coordinates | 7228357.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C35 H30 N10 O9 |
|---|---|
| Calculated formula | C35 H30 N10 O9 |
| Title of publication | A Crab Claw Shaped Molecular Receptor for Selective Recognition of Picric Acid: Supramolecular Self-Assembly Mediated Aggregation Induced Emission and Color Change |
| Authors of publication | Pitchaimani, J.; Kundu, Anu; Karthikeyan, Subramanian; Anthony, Philip Philip; Moon, Dohyun; Madhu, Vedichi |
| Journal of publication | CrystEngComm |
| Year of publication | 2017 |
| a | 10.689 ± 0.002 Å |
| b | 21.09 ± 0.003 Å |
| c | 15.168 ± 0.002 Å |
| α | 90° |
| β | 93.045 ± 0.004° |
| γ | 90° |
| Cell volume | 3414.5 ± 0.9 Å3 |
| Cell temperature | 173 ± 2 K |
| Ambient diffraction temperature | 173 ± 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 | 0.1139 |
| Residual factor for significantly intense reflections | 0.0629 |
| Weighted residual factors for significantly intense reflections | 0.1735 |
| Weighted residual factors for all reflections included in the refinement | 0.194 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
| Diffraction radiation wavelength | 0.63 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 197137 (current) | 2017-06-02 | cif/ Adding structures of 7228356, 7228357 via cif-deposit CGI script. |
7228357.cif |
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