Information card for entry 7221774
| Formula |
C60.5 H42.5 Cl1.5 O6 P6 Se6 |
| Calculated formula |
C60.5 H42.5 Cl1.5 O6 P6 Se6 |
| Title of publication |
Phenylphosphinacalix[3]trifuran: synthesis, coordination and application in the Suzuki-Miyaura cross-coupling reaction in water |
| Authors of publication |
Sun, Yue; Yan, Meng-Qi; Liu, Yan; Lian, Ze-Yu; Meng, Tong; chen, Jian; Liu, Shenghua; Yu, Guang-Ao |
| Journal of publication |
RSC Adv. |
| Year of publication |
2015 |
| a |
11.165 ± 0.002 Å |
| b |
12.927 ± 0.003 Å |
| c |
21.775 ± 0.004 Å |
| α |
83.949 ± 0.003° |
| β |
84.534 ± 0.003° |
| γ |
77.702 ± 0.003° |
| Cell volume |
3045 ± 1.1 Å3 |
| Cell temperature |
200 ± 2 K |
| Ambient diffraction temperature |
200 ± 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 |
0.1081 |
| Residual factor for significantly intense reflections |
0.081 |
| Weighted residual factors for significantly intense reflections |
0.2066 |
| Weighted residual factors for all reflections included in the refinement |
0.2184 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.075 |
| 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/7221774.html
