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Information card for entry 4125005
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Coordinates | 4125005.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | Sn{B(NArCH)2}2(SiH2Ph) |
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Formula | C58 H80 B2 N4 Si Sn |
Calculated formula | C58 H80 B2 N4 Si Sn |
SMILES | [SnH]([SiH2]c1ccccc1)(B1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C)B1N(C=CN1c1c(cccc1C(C)C)C(C)C)c1c(cccc1C(C)C)C(C)C |
Title of publication | Enabling and Probing Oxidative Addition and Reductive Elimination at a Group 14 Metal Center: Cleavage and Functionalization of E-H Bonds by a Bis(boryl)stannylene. |
Authors of publication | Protchenko, Andrey V.; Bates, Joshua I.; Saleh, Liban M. A.; Blake, Matthew P.; Schwarz, Andrew D.; Kolychev, Eugene L.; Thompson, Amber L.; Jones, Cameron; Mountford, Philip; Aldridge, Simon |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2016 |
Journal volume | 138 |
Journal issue | 13 |
Pages of publication | 4555 - 4564 |
a | 12.527 ± 0.0004 Å |
b | 12.6173 ± 0.0005 Å |
c | 21.1768 ± 0.0008 Å |
α | 79.505 ± 0.003° |
β | 89.404 ± 0.003° |
γ | 60.709 ± 0.004° |
Cell volume | 2858.2 ± 0.2 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 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 | 0.0658 |
Residual factor for significantly intense reflections | 0.0614 |
Weighted residual factors for all reflections | 0.0767 |
Weighted residual factors for significantly intense reflections | 0.0721 |
Weighted residual factors for all reflections included in the refinement | 0.0712 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1063 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
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/4125005.html
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Users of the data should acknowledge the original authors of the
structural data.