Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1505658
Preview
Coordinates | 1505658.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H28 Fe N3 P |
---|---|
Calculated formula | C32 H28 Fe N3 P |
SMILES | [Fe]12345678([c]9([C@@H](n%10nnc(c%11ccccc%11)c%10)C)[cH]1[cH]2[cH]3[c]49P(c1ccccc1)c1ccccc1)[cH]1[cH]8[cH]7[cH]6[cH]51 |
Title of publication | ClickFerrophos: new chiral ferrocenyl phosphine ligands synthesized by click chemistry and the use of their metal complexes as catalysts for asymmetric hydrogenation and allylic substitution. |
Authors of publication | Fukuzawa, Shin-ichi; Oki, Hiroshi; Hosaka, Mitsuteru; Sugasawa, Jun; Kikuchi, Satoshi |
Journal of publication | Organic letters |
Year of publication | 2007 |
Journal volume | 9 |
Journal issue | 26 |
Pages of publication | 5557 - 5560 |
a | 11.978 ± 0.014 Å |
b | 14.62 ± 0.03 Å |
c | 14.881 ± 0.018 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2606 ± 7 Å3 |
Cell temperature | 123.1 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 significantly intense reflections | 0.0544 |
Weighted residual factors for all reflections included in the refinement | 0.0545 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.7107 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/1505658.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.