Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1569547
Preview
Coordinates | 1569547.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H31 F3 N4 O3 Ru S |
---|---|
Calculated formula | C32 H31 F3 N4 O3 Ru S |
Title of publication | Efficient additive-free formic acid dehydrogenation with a NNN–ruthenium complex |
Authors of publication | Knörr, Pascal; Lentz, Nicolas; Albrecht, Martin |
Journal of publication | Catalysis Science & Technology |
Year of publication | 2023 |
Journal volume | 13 |
Journal issue | 19 |
Pages of publication | 5625 - 5631 |
a | 18.9076 ± 0.0003 Å |
b | 11.49805 ± 0.00018 Å |
c | 14.5081 ± 0.0002 Å |
α | 90° |
β | 100.559 ± 0.0015° |
γ | 90° |
Cell volume | 3100.66 ± 0.08 Å3 |
Cell temperature | 173.01 ± 0.1 K |
Ambient diffraction temperature | 173.01 ± 0.1 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0818 |
Residual factor for significantly intense reflections | 0.0766 |
Weighted residual factors for significantly intense reflections | 0.2636 |
Weighted residual factors for all reflections included in the refinement | 0.2785 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.203 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/1569547.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.