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Information card for entry 3000306
Preview
No preview available: structure is on hold until 2021-11-21
Coordinates | Coordinates are not available: structure is on hold until 2021-11-21 |
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Chemical name | (R,Sp)-1-(2-(5-fluoro-1-methylindolin-2-yl)ferrocenyl)-N,N-dimethylethan-1-amine |
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Formula | C23 H25 F Fe N2 |
Authors of publication | Rakovský, Erik; Šebesta, Radovan |
Journal of publication | To be published |
a | 9.9977 ± 0.0002 Å |
b | 11.1321 ± 0.0003 Å |
c | 17.8135 ± 0.0004 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1982.56 ± 0.08 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 5 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0238 |
Residual factor for significantly intense reflections | 0.023 |
Weighted residual factors for significantly intense reflections | 0.0566 |
Weighted residual factors for all reflections included in the refinement | 0.057 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54186 Å |
Diffraction radiation type | CuKα |
Has coordinates | No |
Has disorder | No |
Has Fobs | No |
Version history
Not available for prepublication material.
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Users of the data should acknowledge the original authors of the
structural data.