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Information card for entry 4117321
Preview
| Coordinates | 4117321.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C61 H51 F12 I N2 O |
|---|---|
| Calculated formula | C61 H51 F12 I N2 O |
| Title of publication | Catalytic Asymmetric Synthesis of Axially Chiralo-Iodoanilides by Phase-Transfer Catalyzed Alkylations |
| Authors of publication | Seiji Shirakawa; Kun Liu; Keiji Maruoka |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2012 |
| Journal volume | 134 |
| Pages of publication | 916 - 919 |
| a | 16.2335 ± 0.0003 Å |
| b | 20.7081 ± 0.0004 Å |
| c | 18.2329 ± 0.0004 Å |
| α | 90° |
| β | 98.435 ± 0.007° |
| γ | 90° |
| Cell volume | 6063 ± 0.2 Å3 |
| Cell temperature | 153 K |
| Ambient diffraction temperature | 153 K |
| Number of distinct elements | 6 |
| Space group number | 5 |
| Hermann-Mauguin space group symbol | C 1 2 1 |
| Hall space group symbol | C 2y |
| Residual factor for significantly intense reflections | 0.1197 |
| Weighted residual factors for all reflections included in the refinement | 0.3059 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.967 |
| Diffraction radiation wavelength | 1.54187 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178944 (current) | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/73. |
4117321.cif |
| 74391 | 2013-02-26 | cif/ Adding structures of 4117321 via cif-deposit CGI script. |
4117321.cif |
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Users of the data should acknowledge the original authors of the
structural data.