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Information card for entry 7118232
Preview
Coordinates | 7118232.cif |
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Original paper (by DOI) | HTML |
Formula | C31 H30 Br N3 O5 |
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Calculated formula | C31 H30 Br N3 O5 |
Title of publication | Asymmetric synthesis of 3,3'-pyrrolidinyl-dispirooxindoles via a one-pot organocatalytic Mannich/deprotection/aza-Michael sequence. |
Authors of publication | Zhao, Kun; Zhi, Ying; Li, Xinyi; Puttreddy, Rakesh; Rissanen, Kari; Enders, Dieter |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2016 |
Journal volume | 52 |
Journal issue | 11 |
Pages of publication | 2249 - 2252 |
a | 14.6406 ± 0.0002 Å |
b | 9.57209 ± 0.00015 Å |
c | 19.5953 ± 0.0003 Å |
α | 90° |
β | 97.003 ± 0.0014° |
γ | 90° |
Cell volume | 2725.62 ± 0.07 Å3 |
Cell temperature | 123.01 ± 0.1 K |
Ambient diffraction temperature | 123.01 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 5 |
Hermann-Mauguin space group symbol | I 1 2 1 |
Hall space group symbol | I 2y |
Residual factor for all reflections | 0.0295 |
Residual factor for significantly intense reflections | 0.0279 |
Weighted residual factors for significantly intense reflections | 0.0724 |
Weighted residual factors for all reflections included in the refinement | 0.0738 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7118232.html
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