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Information card for entry 7236017
Preview
| Coordinates | 7236017.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | Bis(3N-triazolyl)copper(I) tetrafluoroborate |
|---|---|
| Formula | C30 H26 B Cu F4 N6 |
| Calculated formula | C30 H26 B Cu F4 N6 |
| Title of publication | Copper(i)‒triazole dimer formation and rate acceleration in in-source click reaction |
| Authors of publication | Qiu, Ran; Luo, Hai |
| Journal of publication | RSC Advances |
| Year of publication | 2015 |
| Journal volume | 5 |
| Journal issue | 116 |
| Pages of publication | 96213 |
| a | 24.8641 ± 0.0012 Å |
| b | 6.0228 ± 0.0003 Å |
| c | 18.6609 ± 0.001 Å |
| α | 90° |
| β | 97.811 ± 0.005° |
| γ | 90° |
| Cell volume | 2768.6 ± 0.2 Å3 |
| Cell temperature | 180.01 ± 0.1 K |
| Ambient diffraction temperature | 180.01 ± 0.1 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | I 1 2/c 1 |
| Hall space group symbol | -I 2yc |
| Residual factor for all reflections | 0.0717 |
| Residual factor for significantly intense reflections | 0.0561 |
| Weighted residual factors for significantly intense reflections | 0.1369 |
| Weighted residual factors for all reflections included in the refinement | 0.1482 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.037 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233836 (current) | 2019-11-23 | cif/ Adding structures of 7236017 via cif-deposit CGI script. |
7236017.cif |
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