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Information card for entry 4025351
Preview
Coordinates | 4025351.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C15 H26 O |
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Calculated formula | C15 H26 O |
SMILES | O[C@@]1([C@@H]2[C@@H]3[C@@]2(CC1)[C@@H](CC[C@@H]3C(C)C)C)C |
Title of publication | Stereocontrolled Syntheses of (-)-Cubebol and (-)-10-Epicubebol Involving Intramolecular Cyclopropanation of α-Lithiated Epoxides |
Authors of publication | David M. Hodgson; Saifullah Salik; David J. Fox |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2010 |
Journal volume | 75 |
Pages of publication | 2157 - 2168 |
a | 9.8823 ± 0.0002 Å |
b | 9.5332 ± 0.0002 Å |
c | 30.4082 ± 0.0008 Å |
α | 90° |
β | 91.1046 ± 0.001° |
γ | 90° |
Cell volume | 2864.22 ± 0.11 Å3 |
Cell temperature | 150 K |
Ambient diffraction temperature | 150 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0814 |
Residual factor for significantly intense reflections | 0.0638 |
Weighted residual factors for all reflections | 0.1513 |
Weighted residual factors for significantly intense reflections | 0.1408 |
Weighted residual factors for all reflections included in the refinement | 0.1513 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
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/4025351.html
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Users of the data should acknowledge the original authors of the
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