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Information card for entry 4030975
Preview
Coordinates | 4030975.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C35 H35 N3 O8 |
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Calculated formula | C35 H35 N3 O8 |
SMILES | N1(c2ccccc2[C@@]2(C1=O)[C@H](C(N[C@]12C(=O)N(c2c1cccc2)Cc1ccccc1)(C(=O)OCC)C(=O)OCC)C(=O)OCC)C |
Title of publication | Diastereo- and Enantioselective Construction of 3,3'-Pyrrolidinyldispirooxindole Framework via Catalytic Asymmetric 1,3-Dipolar Cycloadditions. |
Authors of publication | Dai, Wei; Jiang, Xiao-Li; Wu, Qiong; Shi, Feng; Tu, Shu-Jiang |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2015 |
Journal volume | 80 |
Journal issue | 11 |
Pages of publication | 5737 - 5744 |
a | 8.893 ± 0.0003 Å |
b | 25.5926 ± 0.0008 Å |
c | 14.1377 ± 0.0004 Å |
α | 90° |
β | 90.01° |
γ | 90° |
Cell volume | 3217.67 ± 0.17 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0836 |
Residual factor for significantly intense reflections | 0.0799 |
Weighted residual factors for significantly intense reflections | 0.1989 |
Weighted residual factors for all reflections included in the refinement | 0.2048 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4030975.html
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