Information card for entry 7206713
| Formula |
C84 H98.5 Cl7 Cu N4 O10.5 |
| Calculated formula |
C84 H98.5 Cl7 Cu N4 O10.5 |
| Title of publication |
Co-crystal of [CuCl4]2− and L1 and its inclusion compounds with three different guests (L1 = N,N,N′,N′-tetra-p-methoxybenzyl-ethylenediamine) |
| Authors of publication |
Guo, Fang; Zhang, Ming-qian; Lu, Na; Guan, Hong-yu; Tong, Jian; Wang, Bao-xin |
| Journal of publication |
CrystEngComm |
| Year of publication |
2011 |
| Journal volume |
13 |
| Journal issue |
22 |
| Pages of publication |
6753 |
| a |
15.823 ± 0.003 Å |
| b |
17.165 ± 0.003 Å |
| c |
18.838 ± 0.004 Å |
| α |
64.88 ± 0.03° |
| β |
72.07 ± 0.03° |
| γ |
63.17 ± 0.03° |
| Cell volume |
4090.8 ± 1.9 Å3 |
| Cell temperature |
113 ± 2 K |
| Ambient diffraction temperature |
113 ± 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 |
0.0716 |
| Residual factor for significantly intense reflections |
0.057 |
| Weighted residual factors for significantly intense reflections |
0.1557 |
| Weighted residual factors for all reflections included in the refinement |
0.1633 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.054 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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