Table 1.
Crystal data and structure refinement details of 2·2MeOH.
| Empirical formula | C32H46Cl3F6N2O2PRu |
| Formula weight [g mol−1] | 944.17 |
| Temperature [K] | 100 |
| Crystal System | monoclinic |
| Space group | I2/a |
| Radiation/Wavelength [Å] | Mo Ka/0.71073 |
| Unit cell dimension [Å, deg] | a = 21.3209(5), α = 90° b = 10.5848(2), β = 99.702(2)° c = 33.3109(8), γ = 90 |
| Volume | 7410.0(3) Å3 |
| Calculated density | 1.691 Mg m−3 |
| Z | 8 |
| Θ range [deg] | 3.116–29.015 |
| Reflections | |
| Measured: | 41,874 |
| Independent: | 8907 |
| Observed [I > 2s(I)]: | 7696 |
| Rint | 0.0411 |
| R1 [I > 2s(I)], R1 (all) | 0.0354, 0.0442 |
| wR2 [I > 2s(I)], wR2 (all) | 0.0827, 0.0883 |
| Goodness-of-fit on F2 | 1.037 |
| Largest diff. peak/hole (e Å−3) | 1.032/−0.720 |
| CCDC no. | 2217194 |