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Information card for entry 4089594
Preview
Coordinates | 4089594.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H42 Al P3 |
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Calculated formula | C54 H42 Al P3 |
SMILES | [P](c1ccccc1)(c1ccccc1)c1ccccc1[Al]1([P](c2c1cccc2)(c1ccccc1)c1ccccc1)c1ccccc1[P](c1ccccc1)c1ccccc1 |
Title of publication | A Tris(triphenylphosphine)aluminum Ambiphilic Precatalyst for the Reduction of Carbon Dioxide with Catecholborane |
Authors of publication | Courtemanche, Marc-André; Larouche, Jérémie; Légaré, Marc-André; Bi, Wenhua; Maron, Laurent; Fontaine, Frédéric-Georges |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 22 |
Pages of publication | 6804 |
a | 11.002 ± 0.0002 Å |
b | 13.1765 ± 0.0002 Å |
c | 31.9414 ± 0.0006 Å |
α | 87.555 ± 0.001° |
β | 82.89 ± 0.001° |
γ | 77.316 ± 0.001° |
Cell volume | 4482.16 ± 0.14 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0878 |
Residual factor for significantly intense reflections | 0.0526 |
Weighted residual factors for significantly intense reflections | 0.1277 |
Weighted residual factors for all reflections included in the refinement | 0.1402 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.049 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/4089594.html
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Users of the data should acknowledge the original authors of the
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