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Information card for entry 4026103
Preview
Coordinates | 4026103.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H34 N2 O4 |
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Calculated formula | C27 H34 N2 O4 |
SMILES | O1[C@]2(C[C@@H]3C([C@@H]3CC2=N[C@@](C1=O)(C)Cc1c2ccccc2n(c1)C(=O)OC(C)(C)C)(C)C)C |
Title of publication | Asymmetric Synthesis of α-Methyl-α-Amino Acids via Diastereoselective Alkylation of (1S)-(+)-3-Carene Derived Tricyclic Iminolactone |
Authors of publication | Ta-Jung Lu; Cheng-Kun Lin |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 1621 - 1633 |
a | 12.8706 ± 0.0003 Å |
b | 10.3285 ± 0.0002 Å |
c | 19.3024 ± 0.0005 Å |
α | 90° |
β | 94.196 ± 0.002° |
γ | 90° |
Cell volume | 2559.07 ± 0.1 Å3 |
Cell temperature | 297 ± 2 K |
Ambient diffraction temperature | 297 ± 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 | 0.1089 |
Residual factor for significantly intense reflections | 0.0607 |
Weighted residual factors for significantly intense reflections | 0.1411 |
Weighted residual factors for all reflections included in the refinement | 0.1591 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.992 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/4026103.html
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