Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1503368
Preview
Coordinates | 1503368.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H56 Cl2 O2 Rh2 |
---|---|
Calculated formula | C34 H56 Cl2 O2 Rh2 |
SMILES | [Rh]1234([Cl][Rh]567([Cl]1)[C]1(=[CH]5[C@@H]5[CH]6=[CH]7[C@H]1CC5)C(O)(CC(C)C)CC(C)C)[C]1([C@H]5[CH]2=[CH]3[C@@H]([CH]4=1)CC5)C(O)(CC(C)C)CC(C)C |
Title of publication | Catalytic enantioselective formation of chiral-bridged dienes which are themselves ligands for enantioselective catalysis. |
Authors of publication | Brown, M. Kevin; Corey, E. J. |
Journal of publication | Organic letters |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 1 |
Pages of publication | 172 - 175 |
a | 9.2436 ± 0.0017 Å |
b | 15.171 ± 0.003 Å |
c | 24.757 ± 0.005 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3471.8 ± 1.2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 193 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0529 |
Residual factor for significantly intense reflections | 0.0413 |
Weighted residual factors for significantly intense reflections | 0.0875 |
Weighted residual factors for all reflections included in the refinement | 0.0935 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1503368.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.