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Information card for entry 4067629
Preview
Coordinates | 4067629.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C46 H73 Al P2 |
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Calculated formula | C46 H73 Al P2 |
SMILES | [P+]1(c2c(C)cc(C)cc2C)(/C(=C/C(C)(C)C)P([Al](C\1=C\C(C)(C)C)(CC(C)(C)C)CC(C)(C)C)c1c(C)cc(C)cc1C)C#CC(C)(C)C |
Title of publication | C≡C Triple Bond Activation by Heterocyclic Aluminum Phosphinides |
Authors of publication | Westenberg, Hauke; Slootweg, J. Chris; Hepp, Alexander; Kösters, Jutta; Roters, Steffi; Ehlers, Andreas W.; Lammertsma, Koop; Uhl, Werner |
Journal of publication | Organometallics |
Year of publication | 2010 |
Journal volume | 29 |
Journal issue | 6 |
Pages of publication | 1323 |
a | 12.956 ± 0.003 Å |
b | 20.415 ± 0.004 Å |
c | 17.439 ± 0.004 Å |
α | 90° |
β | 93.87 ± 0.03° |
γ | 90° |
Cell volume | 4602 ± 1.8 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0643 |
Residual factor for significantly intense reflections | 0.0375 |
Weighted residual factors for significantly intense reflections | 0.088 |
Weighted residual factors for all reflections included in the refinement | 0.0925 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.805 |
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/4067629.html
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