Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1569095
Preview
| Coordinates | 1569095.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C59 H62 Cl3 O4 P |
|---|---|
| Calculated formula | C59 H62 Cl3 O4 P |
| a | 16.8473 ± 0.0019 Å |
| b | 16.475 ± 0.0019 Å |
| c | 37.556 ± 0.004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 10424 ± 2 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150.15 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.1228 |
| Residual factor for significantly intense reflections | 0.0967 |
| Weighted residual factors for significantly intense reflections | 0.2774 |
| Weighted residual factors for all reflections included in the refinement | 0.2991 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.076 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 283666 (current) | 2023-05-11 | cif/ Adding structures of 1569095 via cif-deposit CGI script. |
1569095.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.