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Information card for entry 4103858
Preview
Coordinates | 4103858.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H26 O6 |
---|---|
Calculated formula | C26 H26 O6 |
SMILES | O1[C@@H](c2c(OC)cc(OC)cc2C=C1c1ccc(OC)cc1)c1cc(OC)cc(OC)c1 |
Title of publication | Total Synthesis of Diverse Carbogenic Complexity within the Resveratrol Class from a Common Building Block |
Authors of publication | Scott A. Snyder; Steven P. Breazzano; Audrey G. Ross; Yunqing Lin; Alexandros L. Zografos |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2009 |
Journal volume | 131 |
Pages of publication | 1753 - 1765 |
a | 12.4139 ± 0.0004 Å |
b | 5.3288 ± 0.0002 Å |
c | 17.1999 ± 0.0006 Å |
α | 90° |
β | 106.471 ± 0.001° |
γ | 90° |
Cell volume | 1091.1 ± 0.07 Å3 |
Cell temperature | 125 ± 2 K |
Ambient diffraction temperature | 125 ± 2 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 | 0.051 |
Residual factor for significantly intense reflections | 0.0416 |
Weighted residual factors for significantly intense reflections | 0.1042 |
Weighted residual factors for all reflections included in the refinement | 0.1099 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
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/4103858.html
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Users of the data should acknowledge the original authors of the
structural data.