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Information card for entry 7001250
Preview
Coordinates | 7001250.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H18 Fe O4 |
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Calculated formula | C16 H18 Fe O4 |
SMILES | [Fe]12345678([c]9([cH]4[cH]3[cH]2[c]19OC(=O)C)C1OCCCO1)[cH]1[cH]5[cH]6[cH]7[cH]81 |
Title of publication | Selective synthesis of the 2-hydroxyferrocene-aldimine enantiomers—extended planar chiral analogues of the “flat” salicylaldimine ligand family |
Authors of publication | Niemeyer, Jochen; Kehr, Gerald; Fröhlich, Roland; Erker, Gerhard |
Journal of publication | Dalton Transactions |
Year of publication | 2009 |
Journal issue | 19 |
Pages of publication | 3716 - 3730 |
a | 16.662 ± 0.001 Å |
b | 7.647 ± 0.001 Å |
c | 11.332 ± 0.001 Å |
α | 90° |
β | 90.75 ± 0.01° |
γ | 90° |
Cell volume | 1443.7 ± 0.2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0836 |
Residual factor for significantly intense reflections | 0.0504 |
Weighted residual factors for significantly intense reflections | 0.0924 |
Weighted residual factors for all reflections included in the refinement | 0.104 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7001250.html
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