Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7157426
Preview
Coordinates | 7157426.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H29 N O4 |
---|---|
Calculated formula | C25 H29 N O4 |
Title of publication | Chiral diene-promoted room temperature conjugate arylation: highly enantioselective synthesis of substituted chiral phenylalanine derivatives and α,α-di(arylmethyl)acetates. |
Authors of publication | Chen, Jian-Ping; Xu, Ming-Hua |
Journal of publication | Organic & biomolecular chemistry |
Year of publication | 2020 |
Journal volume | 18 |
Journal issue | 24 |
Pages of publication | 4569 - 4574 |
a | 9.0309 ± 0.0004 Å |
b | 13.028 ± 0.0005 Å |
c | 19.9637 ± 0.0008 Å |
α | 99.064 ± 0.002° |
β | 98.729 ± 0.002° |
γ | 91.614 ± 0.002° |
Cell volume | 2289.36 ± 0.16 Å3 |
Cell temperature | 173 K |
Ambient diffraction temperature | 173 K |
Number of distinct elements | 4 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.072 |
Residual factor for significantly intense reflections | 0.0702 |
Weighted residual factors for significantly intense reflections | 0.2066 |
Weighted residual factors for all reflections included in the refinement | 0.211 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
253972 (current) | 2020-07-06 | cif/ Updating files of 7157426, 7157427 Original log message: Adding full bibliography for 7157426--7157427.cif. |
7157426.cif |
249779 | 2020-03-27 | cif/ Adding structures of 7157426, 7157427 via cif-deposit CGI script. |
7157426.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.