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Information card for entry 7011444
Preview
Coordinates | 7011444.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H40 B Br Hg N6 S3 |
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Calculated formula | C27 H40 B Br Hg N6 S3 |
Title of publication | Bulky tris(mercaptoimidazolyl)borates: synthesis and molecular structures of the Group 12 metal complexes [TmtBu]MBr (M = Zn, Cd, Hg) |
Authors of publication | White, Jennifer L.; Tanski, Joseph M.; Rabinovich, Daniel |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 2002 |
Journal issue | 15 |
Pages of publication | 2987 |
a | 17.7024 ± 0.001 Å |
b | 10.8838 ± 0.0006 Å |
c | 35.013 ± 0.002 Å |
α | 90° |
β | 96.79 ± 0.001° |
γ | 90° |
Cell volume | 6698.6 ± 0.7 Å3 |
Cell temperature | 243 ± 2 K |
Ambient diffraction temperature | 243 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0656 |
Residual factor for significantly intense reflections | 0.0364 |
Weighted residual factors for significantly intense reflections | 0.0751 |
Weighted residual factors for all reflections included in the refinement | 0.0911 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
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/7011444.html
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structural data.