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Information card for entry 1503598
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Coordinates | 1503598.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Me_Oki_D_1115 |
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Formula | C24 H34 O4 |
Calculated formula | C24 H34 O4 |
SMILES | O=C1O[C@]23C(=C1C(=O)C(=C[C@H](C[C@H](CCC[C@@H]3C=C([C@@H](C2)C)C)C)C)C)OC.O=C1O[C@@]23C(=C1C(=O)C(=C[C@@H](C[C@@H](CCC[C@H]3C=C([C@H](C2)C)C)C)C)C)OC |
Title of publication | A concise total synthesis of (±)- and (-)-okilactomycin d. |
Authors of publication | Niu, Dawen; Hoye, Thomas R. |
Journal of publication | Organic letters |
Year of publication | 2012 |
Journal volume | 14 |
Journal issue | 3 |
Pages of publication | 828 - 831 |
a | 16.5126 ± 0.0011 Å |
b | 6.9927 ± 0.0005 Å |
c | 20.1398 ± 0.0013 Å |
α | 90° |
β | 112.999 ± 0.001° |
γ | 90° |
Cell volume | 2140.6 ± 0.3 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 3 |
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 | 0.0749 |
Residual factor for significantly intense reflections | 0.0442 |
Weighted residual factors for significantly intense reflections | 0.1065 |
Weighted residual factors for all reflections included in the refinement | 0.1299 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/1503598.html
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Users of the data should acknowledge the original authors of the
structural data.