Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1567157
Preview
| Coordinates | 1567157.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C60 H50 N2 O8 S2 |
|---|---|
| Calculated formula | C60 H50 N2 O8 S2 |
| Title of publication | NickelII-catalyzed asymmetric photoenolization/Mannich reaction of (2-alkylphenyl) ketones |
| Authors of publication | Yang, Liangkun; Li, Wang-Yuren; Hou, Liuzhen; Zhan, Tangyu; Cao, Weidi; Liu, Xiaohua; Feng, Xiaoming |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| Journal volume | 13 |
| Journal issue | 29 |
| Pages of publication | 8576 - 8582 |
| a | 9.6145 ± 0.0002 Å |
| b | 18.9746 ± 0.0004 Å |
| c | 26.9615 ± 0.0006 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4918.62 ± 0.18 Å3 |
| Cell temperature | 175 ± 2 K |
| Ambient diffraction temperature | 175 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0333 |
| Residual factor for significantly intense reflections | 0.0319 |
| Weighted residual factors for significantly intense reflections | 0.079 |
| Weighted residual factors for all reflections included in the refinement | 0.0812 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277090 (current) | 2022-08-06 | cif/ Updating files of 1567156, 1567157 Original log message: Adding full bibliography for 1567156--1567157.cif. |
1567157.cif |
| 276159 | 2022-06-23 | cif/ Adding structures of 1567156, 1567157 via cif-deposit CGI script. |
1567157.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.