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Information card for entry 7242587
Preview
| Coordinates | 7242587.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | ORGANIC |
|---|---|
| Formula | C16 H14 Cl N O3 |
| Calculated formula | C16 H14 Cl N O3 |
| SMILES | Clc1cc2N(Cc3ccccc3)C(=O)C(O)(c2cc1)CO |
| Title of publication | Ring-opening hydrolysis of spiro-epoxyoxindoles using a reusable sulfonic acid functionalized nitrogen rich carbon catalyst |
| Authors of publication | Patel, Parth; Tak, Raj Kumar; Parmar, Bhavesh; Dabas, Shilpa; Patel, Brijesh; Suresh, Eringathodi; Khan, Noor-ul H.; Subramanian, Saravanan |
| Journal of publication | RSC Advances |
| Year of publication | 2021 |
| Journal volume | 11 |
| Journal issue | 21 |
| Pages of publication | 12808 - 12814 |
| a | 62.21 ± 0.008 Å |
| b | 17.713 ± 0.002 Å |
| c | 5.2259 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5758.6 ± 1.3 Å3 |
| Cell temperature | 301 ± 2 K |
| Ambient diffraction temperature | 301 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 43 |
| Hermann-Mauguin space group symbol | F d d 2 |
| Hall space group symbol | F 2 -2d |
| Residual factor for all reflections | 0.1448 |
| Residual factor for significantly intense reflections | 0.0635 |
| Weighted residual factors for significantly intense reflections | 0.1328 |
| Weighted residual factors for all reflections included in the refinement | 0.173 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.009 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301870 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/24/ Each referenced PubChem compound corresponds to the full crystal structure. |
7242587.cif |
| 263545 | 2021-04-02 | cif/ Adding structures of 7242586, 7242587, 7242588, 7242589, 7242590 via cif-deposit CGI script. |
7242587.cif |
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Users of the data should acknowledge the original authors of the
structural data.