Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7111139
Preview
Coordinates | 7111139.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C36 H66 Cl2 N4 P2 Pd |
---|---|
Calculated formula | C36 H66 Cl2 N4 P2 Pd |
Title of publication | First catalytic dihydroamination of a phosphaalkyne. Crystal and molecular structure of trans-[PdCl2{P(PriNH)2CH2But}2] |
Authors of publication | Cloke, F. Geoffrey N.; Hitchcock, Peter B.; Nixon, John F.; Wilson, D. James |
Journal of publication | Chemical Communications |
Year of publication | 2000 |
Journal issue | 23 |
Pages of publication | 2387 |
a | 7.869 ± 0.003 Å |
b | 10.919 ± 0.003 Å |
c | 12.754 ± 0.005 Å |
α | 90.44 ± 0.03° |
β | 103.26 ± 0.03° |
γ | 95.81 ± 0.03° |
Cell volume | 1060.6 ± 0.7 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0447 |
Residual factor for significantly intense reflections | 0.0381 |
Weighted residual factors for all reflections | 0.1041 |
Weighted residual factors for significantly intense reflections | 0.0991 |
Goodness-of-fit parameter for all reflections | 1.033 |
Goodness-of-fit parameter for significantly intense reflections | 1.046 |
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/7111139.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.