Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8104921
Preview
| Coordinates | 8104921.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | bi-1,1'-cyclopentane-1,1'-diol |
|---|---|
| Chemical name | bi-1,1'-cyclopentane-1,1'-diol |
| Formula | C10 H18 O2 |
| Calculated formula | C10 H18 O2 |
| Title of publication | The crystal structure of bi-1,1′-cyclopentane-1,1′-diol, C10H18O2 |
| Authors of publication | Hosten, Eric C.; Betz, Richard |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 2021 |
| Journal volume | 236 |
| Journal issue | 1 |
| Pages of publication | 197 - 199 |
| a | 10.0025 ± 0.0005 Å |
| b | 18.8285 ± 0.0009 Å |
| c | 11.2384 ± 0.0006 Å |
| α | 90° |
| β | 115.327 ± 0.002° |
| γ | 90° |
| Cell volume | 1913.11 ± 0.17 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.065 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.1561 |
| Weighted residual factors for all reflections included in the refinement | 0.1606 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.093 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274075 (current) | 2022-03-29 | cif/ Adding structures of 8104921 via cif-deposit CGI script. |
8104921.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.