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Information card for entry 4036087
Preview
| Coordinates | 4036087.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 3e in manuscript |
|---|---|
| Formula | C43 H50 N4 O S Si2 |
| Calculated formula | C43 H50 N4 O S Si2 |
| Title of publication | Azaacenodibenzosuberones. |
| Authors of publication | Brosius, Victor; Müller, Matthias; Borstelmann, Jan; Rominger, Frank; Freudenberg, Jan; Bunz, Uwe H. F. |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2019 |
| a | 16.1832 ± 0.0009 Å |
| b | 9.6851 ± 0.0005 Å |
| c | 26.6042 ± 0.0017 Å |
| α | 90° |
| β | 103.342 ± 0.005° |
| γ | 90° |
| Cell volume | 4057.3 ± 0.4 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1549 |
| Residual factor for significantly intense reflections | 0.0904 |
| Weighted residual factors for significantly intense reflections | 0.1721 |
| Weighted residual factors for all reflections included in the refinement | 0.2134 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.172 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231013 (current) | 2019-11-19 | cif/ Adding structures of 4036083, 4036084, 4036085, 4036086, 4036087, 4036088, 4036089 via cif-deposit CGI script. |
4036087.cif |
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Users of the data should acknowledge the original authors of the
structural data.