Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1556256
Preview
| Coordinates | 1556256.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H18 N2 O |
|---|---|
| Calculated formula | C20 H18 N2 O |
| SMILES | o1c2nc3ccccc3nc2cc1c1ccc(cc1)C(C)(C)C |
| Title of publication | Copper(II) catalyzed expeditious synthesis of furoquinoxalines through a one-pot three-component coupling strategy. |
| Authors of publication | Naresh, Gunaganti; Kant, Ruchir; Narender, Tadigoppula |
| Journal of publication | Organic letters |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 17 |
| Pages of publication | 4528 - 4531 |
| a | 12.413 ± 0.005 Å |
| b | 9.758 ± 0.004 Å |
| c | 13.526 ± 0.006 Å |
| α | 90° |
| β | 95.449 ± 0.007° |
| γ | 90° |
| Cell volume | 1630.9 ± 1.2 Å3 |
| Cell temperature | 293 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 | 0.0702 |
| Residual factor for significantly intense reflections | 0.0597 |
| Weighted residual factors for significantly intense reflections | 0.1737 |
| Weighted residual factors for all reflections included in the refinement | 0.1854 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
| Diffraction radiation wavelength | 0.71075 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243602 (current) | 2019-11-26 | cif/ Adding structures of 1556256 via cif-deposit CGI script. |
1556256.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.