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Information card for entry 2006039
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Coordinates | 2006039.cif |
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Original IUCr paper | HTML |
Chemical name | Meso-1,1'-diphenyl-2,2,2',2'-tetrabromobicyclopropyl |
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Formula | C18 H14 Br4 |
Calculated formula | C18 H14 Br4 |
SMILES | BrC1(Br)[C@](C1)([C@]1(C(Br)(Br)C1)c1ccccc1)c1ccccc1 |
Title of publication | <i>meso</i>-2,2,2',2'-Tetrachloro-1,1'-diphenyl-1,1'-bicyclopropyl and <i>meso</i>-2,2,2',2'-Tetrabromo-1,1'-diphenyl-1,1'-bicyclopropyl |
Authors of publication | Lam, Y.-L.; Koh, L.-L.; Huang, H.-H. |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1997 |
Journal volume | 53 |
Journal issue | 4 |
Pages of publication | 499 - 504 |
a | 8.432 ± 0.002 Å |
b | 9.586 ± 0.002 Å |
c | 11.187 ± 0.002 Å |
α | 87.19 ± 0.02° |
β | 85.51 ± 0.02° |
γ | 78.87 ± 0.02° |
Cell volume | 884 ± 0.3 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0581 |
Residual factor for significantly intense reflections | 0.0421 |
Weighted residual factors for all reflections | 0.0645 |
Weighted residual factors for significantly intense reflections | 0.0547 |
Goodness-of-fit parameter for all reflections | 0.92 |
Goodness-of-fit parameter for significantly intense reflections | 0.77 |
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/2006039.html
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