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Information card for entry 4116103
Preview
Coordinates | 4116103.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H26 B Cl8 Cu F4 N4 |
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Calculated formula | C34 H26 B Cl8 Cu F4 N4 |
Title of publication | Structural Origins of a Dramatic Variation in Catalyst Efficiency in Enantioselective Alkene Aziridination: Implications for Design of Ligands Based on Chiral Biaryldiamines |
Authors of publication | Christopher J. Sanders; Kevin M. Gillespie; David Bell; Peter Scott |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2000 |
Journal volume | 122 |
Pages of publication | 7132 - 7133 |
a | 13.2095 ± 0.0005 Å |
b | 23.9347 ± 0.0005 Å |
c | 25.5398 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8074.8 ± 0.5 Å3 |
Cell temperature | 183 ± 2 K |
Ambient diffraction temperature | 183 ± 2 K |
Number of distinct elements | 7 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.102 |
Residual factor for significantly intense reflections | 0.0895 |
Weighted residual factors for significantly intense reflections | 0.264 |
Weighted residual factors for all reflections included in the refinement | 0.2723 |
Goodness-of-fit parameter for all reflections included in the refinement | 2.131 |
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/4116103.html
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Users of the data should acknowledge the original authors of the
structural data.