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Information card for entry 4082649
Preview
Coordinates | 4082649.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C54 H53 Al F2 P2 |
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Calculated formula | C54 H53 Al F2 P2 |
SMILES | [P+]1(/C(=C\c2ccccc2)[Al](C(C)(C)C)(C(C)(C)C)C(P(c2ccccc2)c2ccccc2)=C1c1ccccc1)(c1ccccc1)c1ccccc1.Fc1c(F)cccc1 |
Title of publication | Al/P-Based Frustrated Lewis Pairs: Limitations of Their Synthesis by Hydroalumination and Formation of Dialkylaluminum Hydride Adducts |
Authors of publication | Uhl, Werner; Appelt, Christian; Backs, Jana; Westenberg, Hauke; Wollschläger, Agnes; Tannert, Jens |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 5 |
Pages of publication | 1212 |
a | 9.514 ± 0.0003 Å |
b | 11.3419 ± 0.0003 Å |
c | 23.2264 ± 0.0007 Å |
α | 93.395 ± 0.002° |
β | 96.178 ± 0.002° |
γ | 114.077 ± 0.002° |
Cell volume | 2260.22 ± 0.12 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 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 | 0.0991 |
Residual factor for significantly intense reflections | 0.0872 |
Weighted residual factors for significantly intense reflections | 0.2152 |
Weighted residual factors for all reflections included in the refinement | 0.2225 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.42 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4082649.html
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