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Information card for entry 4026809
Preview
Coordinates | 4026809.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C23 H29 N O6 |
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Calculated formula | C23 H29 N O6 |
SMILES | [C@]123[C@]4(C(=O)C(=C1CCCCN3[C@@H](CC2)[C@@H]1C[C@@H](C(=O)O1)C)C)C(=C(C(=O)O4)C)OC.[C@@]123[C@@]4(C(=O)C(=C1CCCCN3[C@H](CC2)[C@H]1C[C@H](C(=O)O1)C)C)C(=C(C(=O)O4)C)OC |
Title of publication | Total Synthesis of (\±)-Maistemonine, (\±)-Stemonamide, and (\±)-Isomaistemonine |
Authors of publication | Zhi-Hua Chen; Zhi-Min Chen; Yong-Qiang Zhang; Yong-Qiang Tu; Fu-Min Zhang |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 10173 - 10186 |
a | 8.632 ± 0.007 Å |
b | 11.038 ± 0.009 Å |
c | 12.753 ± 0.011 Å |
α | 105.682 ± 0.008° |
β | 95.718 ± 0.009° |
γ | 110.662 ± 0.007° |
Cell volume | 1068.7 ± 1.5 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 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 | 0.1294 |
Residual factor for significantly intense reflections | 0.0785 |
Weighted residual factors for significantly intense reflections | 0.2434 |
Weighted residual factors for all reflections included in the refinement | 0.2693 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/4026809.html
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Users of the data should acknowledge the original authors of the
structural data.