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Information card for entry 4123622
Preview
Coordinates | 4123622.cif |
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Original paper (by DOI) | HTML |
Formula | C19 H20 N2 O3 |
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Calculated formula | C19 H20 N2 O3 |
SMILES | O=C1N2[C@]34N(c5c([C@@H]3C1=O)cccc5)C(=O)CC[C@]4(CCC2)CC |
Title of publication | Total Syntheses of (-)-Mersicarpine, (-)-Scholarisine G, (+)-Melodinine E, (-)-Leuconoxine, (-)-Leuconolam, (-)-Leuconodine A, (+)-Leuconodine F, and (-)-Leuconodine C: Self-Induced Diastereomeric Anisochronism (SIDA) Phenomenon for Scholarisine G and Leuconodines A and C. |
Authors of publication | Xu, Zhengren; Wang, Qian; Zhu, Jieping |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2015 |
Journal volume | 137 |
Journal issue | 20 |
Pages of publication | 6712 - 6724 |
a | 9.8046 ± 0.0009 Å |
b | 7.4469 ± 0.0004 Å |
c | 11.536 ± 0.0007 Å |
α | 90° |
β | 107.495 ± 0.006° |
γ | 90° |
Cell volume | 803.33 ± 0.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0547 |
Residual factor for significantly intense reflections | 0.0436 |
Weighted residual factors for significantly intense reflections | 0.086 |
Weighted residual factors for all reflections included in the refinement | 0.0922 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.084 |
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/4123622.html
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