Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4514113
Preview
| Coordinates | 4514113.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H23 N O6 |
|---|---|
| Calculated formula | C26.006 H23.005 N O6 |
| Title of publication | Understanding Pathway Complexity of Organic Micro/Nanofiber Growth in Hydrogen-Bonded Coassembly of Aromatic Amino Acids. |
| Authors of publication | Xing, Pengyao; Li, Peizhou; Chen, Hongzhong; Hao, Aiyou; Zhao, Yanli |
| Journal of publication | ACS nano |
| Year of publication | 2017 |
| Journal volume | 11 |
| Journal issue | 4 |
| Pages of publication | 4206 - 4216 |
| a | 10.8621 ± 0.0006 Å |
| b | 5.3971 ± 0.0003 Å |
| c | 18.8997 ± 0.001 Å |
| α | 90° |
| β | 93.336 ± 0.004° |
| γ | 90° |
| Cell volume | 1106.1 ± 0.1 Å3 |
| Cell temperature | 143 ± 2 K |
| Ambient diffraction temperature | 143 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 4 |
| Hermann-Mauguin space group symbol | P 1 21 1 |
| Hall space group symbol | P 2yb |
| Residual factor for all reflections | 0.1002 |
| Residual factor for significantly intense reflections | 0.0785 |
| Weighted residual factors for significantly intense reflections | 0.1846 |
| Weighted residual factors for all reflections included in the refinement | 0.2047 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 195924 (current) | 2017-05-04 | cif/ Adding structures of 4514113 via cif-deposit CGI script. |
4514113.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.