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Information card for entry 7218097
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Coordinates | 7218097.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C28 H28 Br2 O6 |
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Calculated formula | C28 H28 Br2 O6 |
Title of publication | Crystal structure analyses facilitate understanding of synthesis protocols in the preparation of 6,6′-dibromo-substituted BINOL compounds |
Authors of publication | Agnes, Marco; Sorrenti, Alessandro; Pasini, Dario; Wurst, Klaus; Amabilino, David B. |
Journal of publication | CrystEngComm |
Year of publication | 2014 |
Journal volume | 16 |
Journal issue | 43 |
Pages of publication | 10131 |
a | 9.8523 ± 0.0003 Å |
b | 10.1793 ± 0.0003 Å |
c | 13.922 ± 0.0003 Å |
α | 70.723 ± 0.002° |
β | 89.926 ± 0.002° |
γ | 82.549 ± 0.002° |
Cell volume | 1305.53 ± 0.06 Å3 |
Cell temperature | 233 ± 2 K |
Ambient diffraction temperature | 233 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0499 |
Residual factor for significantly intense reflections | 0.0357 |
Weighted residual factors for significantly intense reflections | 0.0804 |
Weighted residual factors for all reflections included in the refinement | 0.0851 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7218097.html
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