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Information card for entry 4084811
Preview
Coordinates | 4084811.cif |
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Original paper (by DOI) | HTML |
Formula | C19 H31 B O3 Si |
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Calculated formula | C19 H31 B O3 Si |
SMILES | C(C=C(C)C)(OB1OC(C(C)(C)O1)(C)C)[Si](C)(C)c1ccccc1 |
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 | 6.5985 ± 0.0004 Å |
b | 9.667 ± 0.0005 Å |
c | 16.074 ± 0.001 Å |
α | 90.232 ± 0.004° |
β | 94.841 ± 0.004° |
γ | 97.806 ± 0.005° |
Cell volume | 1012.07 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0717 |
Residual factor for significantly intense reflections | 0.0519 |
Weighted residual factors for significantly intense reflections | 0.1129 |
Weighted residual factors for all reflections included in the refinement | 0.122 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4084811.html
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