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Information card for entry 4348431
Preview
| Coordinates | 4348431.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C38 H56 B9 N Si2 Zr |
|---|---|
| Calculated formula | C38 H56 B9 N Si2 Zr |
| Title of publication | Synthesis, structure, and alkyne insertion of a mixed-sandwich zirconacarborane alkyl |
| Authors of publication | Liu, Dongmei; Qiu, Zaozao; Xie, Zuowei |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2015 |
| Journal volume | 2 |
| Journal issue | 5 |
| Pages of publication | 467 |
| a | 10.1753 ± 0.0019 Å |
| b | 11.11 ± 0.002 Å |
| c | 22.337 ± 0.004 Å |
| α | 91.666 ± 0.003° |
| β | 91.912 ± 0.003° |
| γ | 114.031 ± 0.003° |
| Cell volume | 2302.5 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.099 |
| Residual factor for significantly intense reflections | 0.0748 |
| Weighted residual factors for significantly intense reflections | 0.22 |
| Weighted residual factors for all reflections included in the refinement | 0.2421 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.956 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 232913 (current) | 2019-11-23 | cif/ Adding structures of 4348429, 4348430, 4348431, 4348432, 4348433, 4348434, 4348435, 4348436, 4348437 via cif-deposit CGI script. |
4348431.cif |
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Users of the data should acknowledge the original authors of the
structural data.