Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4508366
Preview
Coordinates | 4508366.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Bis(acetonitrile)(di-μ-chloro)bis(nitrosyl){bis[oxydibenzene-2,1-diyl)bis(diphenylphosphane-κ<i>P</i>)]}dimolybdenum bis{tetrakis[3'5-bis(trifluoromethyl)phenyl]borate} chlorobenzene pentane solvate |
---|---|
Formula | C151 H103 B2 Cl3 F48 Mo2 N4 O4 P4 |
Calculated formula | C151 H103 B2 Cl3 F48 Mo2 N4 O4 P4 |
Title of publication | Highly Efficient Large Bite Angle Diphosphine Substituted Molybdenum Catalyst for Hydrosilylation |
Authors of publication | Chakraborty, Subrata; Blacque, Olivier; Fox, Thomas; Berke, Heinz |
Journal of publication | ACS Catalysis |
Year of publication | 2013 |
Journal volume | 3 |
Journal issue | 10 |
Pages of publication | 2208 |
a | 16.0776 ± 0.0009 Å |
b | 17.0716 ± 0.0013 Å |
c | 18.0135 ± 0.0014 Å |
α | 105.257 ± 0.007° |
β | 115.011 ± 0.007° |
γ | 98.938 ± 0.005° |
Cell volume | 4116.7 ± 0.6 Å3 |
Cell temperature | 183 ± 2 K |
Ambient diffraction temperature | 183 ± 2 K |
Number of distinct elements | 9 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1467 |
Residual factor for significantly intense reflections | 0.1156 |
Weighted residual factors for significantly intense reflections | 0.2968 |
Weighted residual factors for all reflections included in the refinement | 0.3276 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.179 |
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/4508366.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.