Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1554735
Preview
Coordinates | 1554735.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H33 Cl3 N4 Ni O4 |
---|---|
Calculated formula | C32 H33 Cl3 N4 Ni O4 |
Title of publication | A general synthesis of unnatural α-amino acids by iron-catalysed olefin‒olefin coupling via generated radicals |
Authors of publication | Larionov, Vladimir A.; Stoletova, Nadezhda V.; Kovalev, Vladislav I.; Smol'yakov, Alexander F.; Savel'yeva, Tat'yana F.; Maleev, Victor I. |
Journal of publication | Organic Chemistry Frontiers |
Year of publication | 2019 |
Journal volume | 6 |
Journal issue | 8 |
Pages of publication | 1094 |
a | 9.3743 ± 0.0005 Å |
b | 13.379 ± 0.0007 Å |
c | 14.9327 ± 0.0008 Å |
α | 81.008 ± 0.001° |
β | 89.658 ± 0.001° |
γ | 80.276 ± 0.001° |
Cell volume | 1822.85 ± 0.17 Å3 |
Cell temperature | 120 K |
Ambient diffraction temperature | 120 K |
Number of distinct elements | 6 |
Space group number | 1 |
Hermann-Mauguin space group symbol | P 1 |
Hall space group symbol | P 1 |
Residual factor for all reflections | 0.0609 |
Residual factor for significantly intense reflections | 0.0545 |
Weighted residual factors for significantly intense reflections | 0.146 |
Weighted residual factors for all reflections included in the refinement | 0.1513 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1554735.html
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.