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Information card for entry 7109241
Preview
Coordinates | 7109241.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C35 H38 Br N2 O8 P |
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Calculated formula | C35 H38 Br N2 O8 P |
SMILES | Brc1ccc(cc1)[C@@](NP(=O)(Oc1c(cccc1C)C)Oc1c(cccc1C)C)([C@@H](Nc1ccc(OC)cc1)C(=O)OC)C(=O)OC.Brc1ccc(cc1)[C@](NP(=O)(Oc1c(cccc1C)C)Oc1c(cccc1C)C)([C@H](Nc1ccc(OC)cc1)C(=O)OC)C(=O)OC |
Title of publication | Enantioselective trapping of phosphoramidate ammonium ylides with imino esters for synthesis of 2,3-diaminosuccinic acid derivatives |
Authors of publication | Jun Jiang; Xiaochu Ma; Shunying Liu; Yu Qian; Fengping Lv; Lin Qiu; Xiang Wu; Wenhao Hu |
Journal of publication | Chem.Commun. |
Year of publication | 2013 |
Journal volume | 49 |
Pages of publication | 4238 |
a | 16.9476 ± 0.0006 Å |
b | 14.5627 ± 0.0005 Å |
c | 15.6857 ± 0.0005 Å |
α | 90° |
β | 116.62 ± 0.001° |
γ | 90° |
Cell volume | 3460.9 ± 0.2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.1357 |
Residual factor for significantly intense reflections | 0.0752 |
Weighted residual factors for significantly intense reflections | 0.1901 |
Weighted residual factors for all reflections included in the refinement | 0.2318 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7109241.html
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