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Information card for entry 4023869
Preview
Coordinates | 4023869.cif |
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Original paper (by DOI) | HTML |
Formula | C25 H22 N2 O4 |
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Calculated formula | C25 H22 N2 O4 |
SMILES | O=C1N(c2c([C@@]1(O)[C@@H]1C(=O)N(c3c1cccc3OC)C)cccc2)Cc1ccccc1.O=C1N(c2c([C@]1(O)[C@H]1C(=O)N(c3c1cccc3OC)C)cccc2)Cc1ccccc1 |
Title of publication | A Versatile Synthesis of Unsymmetrical 3,3'-Bioxindoles: Stereoselective Mukaiyama Aldol Reactions of 2-Siloxyindoles with Isatins |
Authors of publication | Ellis, J. Michael; Overman, Larry E.; Tanner, Huw R.; Wang, Jocelyn |
Journal of publication | The Journal of Organic Chemistry |
Year of publication | 2008 |
Journal volume | 73 |
Journal issue | 22 |
Pages of publication | 9151 - 9154 |
a | 9.1562 ± 0.0012 Å |
b | 10.6764 ± 0.0014 Å |
c | 12.1295 ± 0.0016 Å |
α | 111.929 ± 0.002° |
β | 108.08 ± 0.002° |
γ | 93.745 ± 0.002° |
Cell volume | 1023.3 ± 0.2 Å3 |
Cell temperature | 155 ± 2 K |
Ambient diffraction temperature | 155 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0434 |
Residual factor for significantly intense reflections | 0.0369 |
Weighted residual factors for significantly intense reflections | 0.094 |
Weighted residual factors for all reflections included in the refinement | 0.0995 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.033 |
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/4023869.html
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Users of the data should acknowledge the original authors of the
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