Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7220494
Preview
| Coordinates | 7220494.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C76 H84 N4 O16 |
|---|---|
| Calculated formula | C76 H84 N4 O16 |
| Title of publication | L-Proline Nitrate: A Recyclable and Green Catalyst for the Synthesis of Highly Functionalized Piperidines |
| Authors of publication | Agrawal, Nikita R.; Bahekar, Sandeep P.; Sarode, Prashant B.; Zade, Sanjio S.; Chandak, Hemant S. |
| Journal of publication | RSC Adv. |
| Year of publication | 2015 |
| a | 10.651 ± 0.0005 Å |
| b | 17.544 ± 0.001 Å |
| c | 19.4237 ± 0.0007 Å |
| α | 111.929 ± 0.005° |
| β | 90.797 ± 0.004° |
| γ | 91.318 ± 0.004° |
| Cell volume | 3365 ± 0.3 Å3 |
| Cell temperature | 100 ± 0.1 K |
| Ambient diffraction temperature | 100 ± 0.1 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0813 |
| Residual factor for significantly intense reflections | 0.0579 |
| Weighted residual factors for significantly intense reflections | 0.1732 |
| Weighted residual factors for all reflections included in the refinement | 0.1855 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 136943 (current) | 2015-05-19 | cif/ Adding structures of 7220494 via cif-deposit CGI script. |
7220494.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.