Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7247822
Preview
Coordinates | 7247822.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H29 Co N4 O13 P |
---|---|
Calculated formula | C19 H29 Co N4 O13 P |
Title of publication | Mimic uracil–uracil base pairing: self-assembly and single crystal structure |
Authors of publication | Zhang, Menglei; Li, Zhongkui; Zhu, Yanhong; Yan, Li; Zhong, Xue; Zhang, Yijie; Li, Ziyao; Bai, Yixiang; Li, Hui |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 3 |
Pages of publication | 261 - 267 |
a | 7.9718 ± 0.0005 Å |
b | 14.0812 ± 0.0009 Å |
c | 11.5373 ± 0.0008 Å |
α | 90° |
β | 95.204 ± 0.002° |
γ | 90° |
Cell volume | 1289.75 ± 0.15 Å3 |
Cell temperature | 296.15 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 6 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0436 |
Residual factor for significantly intense reflections | 0.0333 |
Weighted residual factors for significantly intense reflections | 0.063 |
Weighted residual factors for all reflections included in the refinement | 0.0664 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.977 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
289457 (current) | 2024-02-04 | cif/ Updating files of 7247822, 7247823, 7247824, 7247825, 7247826 Original log message: Adding full bibliography for 7247822--7247826.cif. |
7247822.cif |
288022 | 2023-12-05 | cif/ Adding structures of 7247822, 7247823, 7247824, 7247825, 7247826 via cif-deposit CGI script. |
7247822.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.