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Information card for entry 4119731
Preview
Coordinates | 4119731.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H18 O6 |
---|---|
Calculated formula | C9 H18 O6 |
SMILES | OC[C@H]1O[C@H](OC)[C@H](OC)[C@@H](OC)[C@@H]1O |
Title of publication | Polycarbonates Derived from Glucose via an Organocatalytic Approach |
Authors of publication | Koichiro Mikami; Alexander T. Lonnecker; Tiffany P. Gustafson; Nathanael F. Zinnel; Pei-Jing Pai; David H. Russell; Karen L. Wooley |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2013 |
Journal volume | 135 |
Pages of publication | 6826 - 6829 |
a | 9.4244 ± 0.0002 Å |
b | 9.4244 ± 0.0002 Å |
c | 22.8217 ± 0.0005 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 1755.44 ± 0.07 Å3 |
Cell temperature | 110 ± 2 K |
Ambient diffraction temperature | 110 ± 2 K |
Number of distinct elements | 3 |
Space group number | 154 |
Hermann-Mauguin space group symbol | P 32 2 1 |
Hall space group symbol | P 32 2" |
Residual factor for all reflections | 0.0313 |
Residual factor for significantly intense reflections | 0.0292 |
Weighted residual factors for significantly intense reflections | 0.078 |
Weighted residual factors for all reflections included in the refinement | 0.0798 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
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/4119731.html
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Users of the data should acknowledge the original authors of the
structural data.