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Information card for entry 4084812
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Coordinates | 4084812.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C79 H109 B Cu2 N4 O4 Si |
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Calculated formula | C79 H109 B Cu2 N4 O4 Si |
Title of publication | CuI-Catalyzed Conjugate Addition of Silyl Boronic Esters: Retracing Catalytic Cycles Using Isolated Copper and Boron Enolate Intermediates |
Authors of publication | Plotzitzka, Jacqueline; Kleeberg, Christian |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 23 |
Pages of publication | 6915 |
a | 12.7068 ± 0.0006 Å |
b | 16.1349 ± 0.0008 Å |
c | 19.5473 ± 0.0009 Å |
α | 84.258 ± 0.004° |
β | 74.488 ± 0.004° |
γ | 85.516 ± 0.004° |
Cell volume | 3836.8 ± 0.3 Å3 |
Cell temperature | 101 ± 3 K |
Ambient diffraction temperature | 101 ± 3 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0631 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.1404 |
Weighted residual factors for all reflections included in the refinement | 0.1462 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
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/4084812.html
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