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Information card for entry 7232496
Preview
Coordinates | 7232496.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C12 H13 Br O4 |
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Calculated formula | C12 H13 Br O4 |
Title of publication | Functionalised tetrahydrofuran fragments from carbohydrates or sugar beet pulp biomass |
Authors of publication | Benhamou, Laure; Foster, Robert W.; Ward, David P.; Wheelhouse, Katherine; Sloan, Lisa; Tame, Christopher J.; Bučar, Dejan-Krešimir; Lye, Gary J.; Hailes, Helen C.; Sheppard, Tom D. |
Journal of publication | Green Chemistry |
Year of publication | 2019 |
Journal volume | 21 |
Journal issue | 8 |
Pages of publication | 2035 |
a | 22.3597 ± 0.0005 Å |
b | 5.5295 ± 0.0002 Å |
c | 9.5976 ± 0.0002 Å |
α | 90° |
β | 90.661 ± 0.002° |
γ | 90° |
Cell volume | 1186.55 ± 0.06 Å3 |
Cell temperature | 150 ± 0.1 K |
Ambient diffraction temperature | 150 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 5 |
Hermann-Mauguin space group symbol | C 1 2 1 |
Hall space group symbol | C 2y |
Residual factor for all reflections | 0.0227 |
Residual factor for significantly intense reflections | 0.0224 |
Weighted residual factors for significantly intense reflections | 0.0599 |
Weighted residual factors for all reflections included in the refinement | 0.0604 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7232496.html
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