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Information card for entry 4026544
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Coordinates | 4026544.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 08003 |
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Formula | C26 H46 O4 Si |
Calculated formula | C26 H46 O4 Si |
SMILES | [Si](O[C@H]1[C@]2(O[C@H]3C([C@H]1O)=C([C@]([C@@H](C3)C)(CCC(=CCC2)C)C)CO)C)(CC)(CC)CC.[Si](O[C@@H]1[C@@]2(O[C@@H]3C([C@@H]1O)=C([C@@]([C@H](C3)C)(CCC(=CCC2)C)C)CO)C)(CC)(CC)CC |
Title of publication | Total Synthesis of (\±)-Phomactin A. Lessons Learned from Respecting a Challenging Structural Topology |
Authors of publication | Grant S. Buchanan; Kevin P. Cole; Yu Tang; Richard P. Hsung |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2011 |
Journal volume | 76 |
Pages of publication | 7027 - 7039 |
a | 7.8063 ± 0.0005 Å |
b | 12.4919 ± 0.0009 Å |
c | 14.4086 ± 0.001 Å |
α | 68.686 ± 0.001° |
β | 79.523 ± 0.001° |
γ | 74.993 ± 0.001° |
Cell volume | 1258.29 ± 0.15 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0716 |
Residual factor for significantly intense reflections | 0.045 |
Weighted residual factors for significantly intense reflections | 0.1003 |
Weighted residual factors for all reflections included in the refinement | 0.1147 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.006 |
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/4026544.html
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Users of the data should acknowledge the original authors of the
structural data.