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Information card for entry 4084520
Preview
Coordinates | 4084520.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C60 H78 Al2 |
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Calculated formula | C60 H78 Al2 |
SMILES | c1(c(cccc1c1c(C(C)C)cccc1C(C)C)c1c(cccc1C(C)C)C(C)C)[AlH]1[H][AlH](c2c(cccc2c2c(cccc2C(C)C)C(C)C)c2c(cccc2C(C)C)C(C)C)[H]1 |
Title of publication | Hydroalumination of Alkenes and Alkynes by Primary Aluminum Hydrides under Mild Conditions |
Authors of publication | Fettinger, James C.; Gray, Paul A.; Melton, Christopher E.; Power, Philip P. |
Journal of publication | Organometallics |
Year of publication | 2014 |
Journal volume | 33 |
Journal issue | 21 |
Pages of publication | 6232 |
a | 9.3526 ± 0.0005 Å |
b | 12.7727 ± 0.0006 Å |
c | 12.9546 ± 0.0006 Å |
α | 110.296 ± 0.0014° |
β | 98.1894 ± 0.0016° |
γ | 111.323 ± 0.0017° |
Cell volume | 1286.63 ± 0.11 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0393 |
Residual factor for significantly intense reflections | 0.0389 |
Weighted residual factors for significantly intense reflections | 0.1062 |
Weighted residual factors for all reflections included in the refinement | 0.1066 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
Diffraction radiation wavelength | 1.54178 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/4084520.html
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Users of the data should acknowledge the original authors of the
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