Information card for entry 7039144
| Formula |
C40 H64 B2 Cu2 N8 |
| Calculated formula |
C40 H64 B2 Cu2 N8 |
| Title of publication |
Catalyst design based on agostic interactions: synthesis, characterization, and catalytic activity of bis(pyrazolyl)borate copper complexes. |
| Authors of publication |
Cao, Hou-Ji; Zhao, Qianyi; Zhang, Qian-Fan; Li, Jiaxuan; Hamilton, Ewan J. M.; Zhang, Jie; Wang, Lai-Sheng; Chen, Xuenian |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2016 |
| Journal volume |
45 |
| Journal issue |
25 |
| Pages of publication |
10194 - 10199 |
| a |
20.5734 ± 0.0014 Å |
| b |
18.8925 ± 0.0014 Å |
| c |
10.6494 ± 0.0007 Å |
| α |
90° |
| β |
98.618 ± 0.002° |
| γ |
90° |
| Cell volume |
4092.5 ± 0.5 Å3 |
| Cell temperature |
103 ± 2 K |
| Ambient diffraction temperature |
103 ± 2 K |
| Number of distinct elements |
5 |
| 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 |
0.06 |
| Residual factor for significantly intense reflections |
0.0367 |
| Weighted residual factors for significantly intense reflections |
0.0819 |
| Weighted residual factors for all reflections included in the refinement |
0.0899 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.032 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/7039144.html
