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Information card for entry 7124821
Preview
Coordinates | 7124821.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C77 H66 B4 Cl6 |
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Calculated formula | C77 H66 B4 Cl6 |
Title of publication | Synthesis and fluxional behaviour of novel chloroborole dimers. |
Authors of publication | Zhang, Zuolun; Wang, Zheng; Haehnel, Martin; Eichhorn, Antonius; Edkins, Robert M.; Steffen, Andreas; Krueger, Anke; Lin, Zhenyang; Marder, Todd B. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2016 |
Journal volume | 52 |
Journal issue | 62 |
Pages of publication | 9707 - 9710 |
a | 12.3724 ± 0.0003 Å |
b | 16.262 ± 0.0004 Å |
c | 18.3411 ± 0.0005 Å |
α | 68.034 ± 0.001° |
β | 76.109 ± 0.001° |
γ | 68.507 ± 0.001° |
Cell volume | 3161.58 ± 0.14 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0488 |
Residual factor for significantly intense reflections | 0.0408 |
Weighted residual factors for significantly intense reflections | 0.1081 |
Weighted residual factors for all reflections included in the refinement | 0.1159 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.173 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7124821.html
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Users of the data should acknowledge the original authors of the
structural data.