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Information card for entry 1529305
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Coordinates | 1529305.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H12 O2 |
---|---|
Calculated formula | C9 H12 O2 |
SMILES | Oc1ccc(cc1)CCCO |
Title of publication | Convergent reductive depolymerization of wood lignin to isolated phenol derivatives by metal-free catalytic hydrosilylation |
Authors of publication | Feghali, Elias; Carrot, Géraldine; Thuéry, Pierre; Genre, Caroline; Cantat, Thibault |
Journal of publication | Energy Environ. Sci. |
Year of publication | 2015 |
Journal volume | 8 |
Journal issue | 9 |
Pages of publication | 2734 |
a | 18.8855 ± 0.0012 Å |
b | 7.9784 ± 0.0006 Å |
c | 11.2136 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1689.62 ± 0.19 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 3 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.0378 |
Residual factor for significantly intense reflections | 0.0327 |
Weighted residual factors for significantly intense reflections | 0.0793 |
Weighted residual factors for all reflections included in the refinement | 0.0815 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
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/1529305.html
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Users of the data should acknowledge the original authors of the
structural data.